Estramustine

Estramustine

SCHEMBL7200287

C[C@]12CC[C@@H]3c4ccc(OC(=O)N(CCCl)CCCl)cc4CC[C@H]3[C@@H]1CC[C@H]2O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RECQL P46063 2/20 1.00
▸ BLM P54132 2/20 1.00
▸ ESR1 P03372 6/20 0.76
▸ ADORA3 P0DMS8 3/20 0.76
▸ INPPL1 O15357 1/20 0.76
▸ PTPN1 P18031 1/20 0.76
▸ DRD1 P21728 1/20 0.76
▸ PTPN6 P29350 1/20 0.76
▸ KDR P35968 1/20 0.76
▸ PTPN11 Q06124 1/20 0.76
▸ LMNA P02545 5/20 0.73
▸ SMN1; SMN2 Q16637 3/20 0.73
▸ ATM Q13315 2/20 0.73
▸ PGR P06401 2/20 0.73
▸ AR P10275 2/20 0.73
▸ SLC6A3 Q01959 2/20 0.73
▸ CHRM1 P11229 1/20 0.73
▸ TBXA2R P21731 1/20 0.73
▸ ADRA1A P35348 1/20 0.73
▸ OPRM1 P35372 1/20 0.73

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Estramustine SCHEMBL13753350 1.00 RECQL (1.00) RECQLBLMESR1ADORA3INPPL1
Estramustine SCHEMBL14031683 1.00 RECQL (1.00) RECQLBLMESR1ADORA3INPPL1
Estramustine SCHEMBL8173336 1.00 RECQL (1.00) RECQLBLMESR1ADORA3INPPL1
Estramustine SCHEMBL29374661 1.00 RECQL (1.00) RECQLBLMESR1ADORA3INPPL1
Estramustine SCHEMBL6353316 1.00 RECQL (1.00) RECQLBLMESR1ADORA3INPPL1
Estramustine SCHEMBL2348477 1.00 RECQL (1.00) RECQLBLMESR1ADORA3INPPL1
Estramustine SCHEMBL4252 1.00 RECQL (1.00) RECQLBLMESR1ADORA3INPPL1
Estramustine SCHEMBL29349776 1.00 RECQL (1.00) RECQLBLMESR1ADORA3INPPL1
Estramustine SCHEMBL679202 0.99 RECQL (0.98) RECQLBLMESR1ADORA3INPPL1
Estramustine SCHEMBL7621246 0.99 RECQL (0.98) RECQLBLMESR1ADORA3INPPL1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12637492-B2 Peptide inhibitors of focal adhesion kinase activity and uses thereof ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2026-05-26 — — US disclosed
US-20260014080-A1 LIPOSOMAL PREPARATION WITH ENCAPSULATED HORMONES, METHOD OF PRODUCTION AND USE THEREOF VAN BOGAERT GINA (BE) 2026-01-15 — — US disclosed
US-12521386-B2 Small molecule inhibitors of the androgen receptor activity and/or expression and uses thereof ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2026-01-13 — — US disclosed
US-12509468-B2 Quindoline compounds and uses thereof ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2025-12-30 — — US disclosed
US-11944626-B2 Small molecule inhibitors of ALDH and uses thereof THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2024-04-02 — — US disclosed
WO-2023223235-A1 LIPOSOMAL PREPARATION WITH ENCAPSULATED HORMONES, METHOD OF PRODUCTION AND USE THEREOF PURNA PHARMACEUTICALS NV (BE) 2023-11-23 — — WO disclosed
US-20230041761-A1 SMALL MOLECULE MODULATORS OF SIGMA-1 AND SIGMA-2 RECEPTORS AND USES THEREOF NORTHWESTERN UNIVERSITY 2023-02-09 — — US disclosed
US-20220306692-A1 PEPTIDE INHIBITORS OF FOCAL ADHESION KINASE ACTIVITY AND USES THEREOF ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA 2022-09-29 — — US disclosed
US-20220098210-A1 QUINDOLINE COMPOUNDS AND USES THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2022-03-31 — — US disclosed
US-20220081412-A1 QUINOLINYL-PYRAZINE-CARBOXAMIDE COMPOUNDS AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF MICHIGAN 2022-03-17 — — US disclosed
US-20220062278-A1 SMALL MOLECULE INHIBITORS OF THE ANDROGEN RECEPTOR ACTIVITY AND/OR EXPRESSION AND USES THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2022-03-03 — — US disclosed
US-20030114379-A1 Methods of treating or preventing cell, tissue, and organ damage using human myeloid progenitor inhibitory factor-1 (MPIF-1) HUMAN GENOME SCIENCES, INC. 2003-06-19 — — US disclosed
US-6495129-B1 Methods of inhibiting hematopoietic stem cells using human myeloid progenitor inhibitory factor-1 (MPIF-1) (Ckbeta-8/MIP-3) HUMAN GENOME SCIENCES, INC. 2002-12-17 — — US disclosed
WO-2001026676-A9 METHODS OF TREATING OR PREVENTING CELL, TISSUE, AND ORGAN DAMAGE USING HUMAN MYELOID PROGENITOR INHIBITORY FACTOR-1 (MPIF-1) HUMAN GENOME SCIENCES INC (US) 2002-11-07 — — WO disclosed
US-6444420-B2 NERVOUS SYSTEM DISORDERS THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2002-09-03 — — US disclosed
EP-1225911-A1 METHODS OF TREATING OR PREVENTING CELL, TISSUE, AND ORGAN DAMAGE USING HUMAN MYELOID PROGENITOR INHIBITORY FACTOR-1 (MPIF-1) Human Genome Sciences (US) 2002-07-31 — — EP disclosed
US-20010016325-A1 Activation of novel estrogen receptor supports and neuronal viability and function BOARD OF TRUSTEE OF THE LELAND STANFORD JUNIOR UNIVERSITY, THE 2001-08-23 — — US disclosed
US-6265147-B1 DETECTING MODULATORS OF BRAIN ACTIVITY; MIX MODULATOR WITH RECEPTORS AND DETECT ACTIVATION OF RECEPTORS THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2001-07-24 — — US disclosed
WO-2001039780-A1 ACTIVATION OF NOVEL ESTROGEN RECEPTOR SUPPORTS NEURONAL VIABILITY AND FUNCTION THE BOARD OF TRUSTEES OF THE LELAND STANDFORD JUNIOR UNIVERSITY (US) 2001-06-07 — — WO disclosed
WO-2001026676-A1 METHODS OF TREATING OR PREVENTING CELL, TISSUE, AND ORGAN DAMAGE USING HUMAN MYELOID PROGENITOR INHIBITORY FACTOR-1 (MPIF-1) HUMAN GENOME SCIENCES, INC. (US) 2001-04-19 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (10 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20220081412-A1 QUINOLINYL-PYRAZINE-CARBOXAMIDE COMPOUNDS AND USES THEREOF HMGB3, HCCS, ACACA RECQL 842/4885BLM 4262/4885ESR1 4121/4885
US-20260014080-A1 LIPOSOMAL PREPARATION WITH ENCAPSULATED HORMONES, METHOD OF PRODUCTION AND USE THEREOF NR5A1, SHBG, GNRHR RECQL 1381/4885BLM 3269/4885ESR1 188/4885
US-20220098210-A1 QUINDOLINE COMPOUNDS AND USES THEREOF RECQL, XPO7, XPOT RECQL 1/4885BLM 198/4885ESR1 819/4885
US-12509468-B2 Quindoline compounds and uses thereof TPD52L2, BRDT, RECQL RECQL 3/4885BLM 571/4885ESR1 481/4885
US-20220062278-A1 SMALL MOLECULE INHIBITORS OF THE ANDROGEN RECEPTOR ACTIVITY AND/OR EXPRESSION AND USES THEREOF AR, KLK3, FSHR RECQL 4803/4885BLM 4871/4885ESR1 41/4885
US-11944626-B2 Small molecule inhibitors of ALDH and uses thereof ALDH2, ALDH1A1, ALDH3A1 RECQL 505/4885BLM 4076/4885ESR1 2866/4885
US-20220306692-A1 PEPTIDE INHIBITORS OF FOCAL ADHESION KINASE ACTIVITY AND USES THEREOF PTK2, LTK, LIMK2 RECQL 3046/4885BLM 1231/4885ESR1 4623/4885
US-20010016325-A1 Activation of novel estrogen receptor supports and neuronal viability and function ESR1, GPER1, ESR2 RECQL 4455/4885BLM 4802/4885ESR1 1/4885
US-12637492-B2 Peptide inhibitors of focal adhesion kinase activity and uses thereof PTK2, ILK, FPR2 RECQL 3626/4885BLM 1631/4885ESR1 1821/4885
US-20230041761-A1 SMALL MOLECULE MODULATORS OF SIGMA-1 AND SIGMA-2 RECEPTORS AND USES THEREOF SIGMAR1, TMEM97, OPRM1 RECQL 2976/4885BLM 4799/4885ESR1 857/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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