Estramustine

Estramustine

SCHEMBL3974

C[C@]12CC[C@@H]3c4ccc(OC(=O)N(CCCl)CCCl)cc4CC[C@H]3[C@@H]1CC[C@@H]2O.O=P([O-])(O)O.[Na+]

nearest known ligand 0.89

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

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

The experimentally established mechanism targets of Estramustine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR known ✓ P35968 1/20 0.76
ADRA1A known ✓ P35348 1/20 0.65
OPRM1 known ✓ P35372 1/20 0.65
RECQL P46063 2/20 0.89
BLM P54132 2/20 0.89
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
PTPN11 Q06124 1/20 0.76
LMNA P02545 5/20 0.65
SMN1; SMN2 Q16637 3/20 0.65
ATM Q13315 2/20 0.65
PGR P06401 2/20 0.65
AR P10275 2/20 0.65
SLC6A3 Q01959 2/20 0.65
CHRM1 P11229 1/20 0.65
TBXA2R P21731 1/20 0.65

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 SCHEMBL2534637 0.99 RECQL (0.87) RECQLBLMESR1ADORA3INPPL1
Estramustine SCHEMBL7552087 0.98 RECQL (0.89) RECQLBLMESR1ADORA3INPPL1
Estramustine SCHEMBL19197890 0.98 RECQL (0.92) RECQLBLMESR1ADORA3INPPL1
Estramustine SCHEMBL17350515 0.98 RECQL (0.90) RECQLBLMESR1ADORA3INPPL1
Estramustine SCHEMBL9509552 0.97 RECQL (0.89) RECQLBLMESR1ADORA3INPPL1
Estramustine SCHEMBL8342744 0.96 RECQL (0.93) RECQLBLMESR1ADORA3INPPL1
Estramustine SCHEMBL22129748 0.96 RECQL (0.93) RECQLBLMESR1ADORA3INPPL1
Estramustine SCHEMBL3625800 0.96 RECQL (0.93) RECQLBLMESR1ADORA3INPPL1
Estramustine SCHEMBL36761 0.96 RECQL (0.93) RECQLBLMESR1ADORA3INPPL1
Estramustine SCHEMBL15710412 0.95 RECQL (0.92) 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

Appears in 18986 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2026100969-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING SARCOPENIA 아주대학교 산학협력단 2026-05-15 WO claimed
EP-4735116-A2 ANTI-TRAILR2 ANTIGEN-BINDING PROTEINS AND USES THEREOF ODYSSEY THERAPEUTICS, INC. (US) 2026-05-06 EP claimed
US-20260116861-A1 ISOXAZOLE HYDROXAMIC ACIDS AS HISTONE DEACETYLASE 6 INHIBITORS THE GEORGE WASHINGTON UNIVERSITY, A CONGRESSIONALLY CHARTERED NOT-FOR-PROFIT CORPORATION (US) 2026-04-30 US claimed
EP-4694914-A1 INHIBITION OF: STROMA/CANCER CELL CROSS-TALK &/OR STROMA GENERATED RESISTANCE TO TREATMENT STERLING IP PTE LTD (SG) 2026-02-18 EP claimed
EP-4694915-A1 TREATMENT OF HAEMATOLOGICAL CANCER STERLING IP PTE LTD (SG) 2026-02-18 EP claimed
US-20260034101-A1 ANTIMITOTIC AMIDES FOR THE TREATMENT OF CANCER AND PROLIFERATIVE DISORDERS FROST BIOLOGIC INC (US) 2026-02-05 US claimed
US-12527836-B2 Gla domains as targeting agents GLAdiator Biosciences, Inc. (US) 2026-01-20 US claimed
US-12522572-B2 Isoxazole hydroxamic acids as histone deacetylase 6 inhibitors THE GEORGE WASHINGTON UNIVERSITY, A CONGRESSIONALLY CHARTERED NOT-FOR-PROFIT CORPORATION (US) 2026-01-13 US claimed
US-12383533-B2 Antimitotic amides for the treatment of cancer and proliferative disorders FROST BIOLOGIC, INC. (US) 2025-08-12 US claimed
US-12364682-B2 Use of tegaserod in preparation of anti-tumor drug QINGDAO HAIJI BIOMEDICINE CO., LTD. (CN) 2025-07-22 US claimed
WO-1997044336-A9 CONJUGATES OF CIS-DOCOSAHEXAENOIC ACID AND PACLITAXEL 1998-04-16 WO claimed
WO-1997044026-A1 COMPOSITIONS COMPRISING CONJUGATES OF CIS-DOCOSAHEXAENOIC ACID AND TAXOTERE NEUROMEDICA, INC. (US) 1997-11-27 WO claimed
WO-1997044336-A1 CONJUGATES OF CIS-DOCOSAHEXAENOIC ACID AND PACLITAXEL NEUROMEDICA, INC. (US) 1997-11-27 WO claimed
WO-1997042964-A1 METHOD AND PRODUCT FOR PROMOTING HAIR GROWTH AND TREATING SKIN CONDITIONS UNIVERSAL BIOLOG ENTERPRISES I (US) 1997-11-20 WO claimed
EP-0794784-A1 COMBINATION CHEMOTHERAPY OF SURAMIN AND A VINCA-ALKALOID OR ESTRAMUSTINE WARNER-LAMBERT COMPANY (US) 1997-09-17 EP claimed
EP-0769938-A1 A NOVEL DRUG DELIVERY SYSTEM THERAPICON SRL (IT) 1997-05-02 EP claimed
WO-1996019226-A1 COMBINATION CHEMOTHERAPY OF SURAMIN AND A VINCA-ALKALOID OR ESTRAMUSTINE WARNER-LAMBERT COMPANY (US) 1996-06-27 WO claimed
WO-1996001612-A1 A NOVEL DRUG DELIVERY SYSTEM THERAPICON S.R.L. (IT) 1996-01-25 WO claimed
EP-0393575-B1 Neoplasia treatment compositions containing antineoplastic agent and side-effect reducing protective agent SEARLE & CO (US) 1994-03-16 EP claimed
US-4115414-A ESTRAMUSTINE PHOSPHATE ALCOHOL COMPLEXES, THEIR PREPARATION, AND THEIR USE AS INTERMEDIATES IN PURIFICATION OF SAID COMPOUND AND SALTS THEREOF AKTIEBOLAGET LEO (SE) 1978-09-19 US claimed