Estramustine

Estramustine

SCHEMBL36761

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

nearest known ligand 0.93

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 0.79
ADRA1A known ✓ P35348 1/20 0.68
OPRM1 known ✓ P35372 1/20 0.68
RECQL P46063 2/20 0.93
BLM P54132 2/20 0.93
ESR1 P03372 6/20 0.79
ADORA3 P0DMS8 3/20 0.79
INPPL1 O15357 1/20 0.79
PTPN1 P18031 1/20 0.79
DRD1 P21728 1/20 0.79
PTPN6 P29350 1/20 0.79
PTPN11 Q06124 1/20 0.79
LMNA P02545 5/20 0.68
SMN1; SMN2 Q16637 3/20 0.68
ATM Q13315 2/20 0.68
PGR P06401 2/20 0.68
AR P10275 2/20 0.68
SLC6A3 Q01959 2/20 0.68
CHRM1 P11229 1/20 0.68
TBXA2R P21731 1/20 0.68

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 SCHEMBL8342744 1.00 RECQL (0.93) RECQLBLMESR1ADORA3INPPL1
Estramustine SCHEMBL22129748 1.00 RECQL (0.93) RECQLBLMESR1ADORA3INPPL1
Estramustine SCHEMBL3625800 1.00 RECQL (0.93) RECQLBLMESR1ADORA3INPPL1
Estramustine SCHEMBL15710412 0.99 RECQL (0.92) RECQLBLMESR1ADORA3INPPL1
Estramustine SCHEMBL13753350 0.97 RECQL (1.00) RECQLBLMESR1ADORA3INPPL1
Estramustine SCHEMBL7200287 0.97 RECQL (1.00) RECQLBLMESR1ADORA3INPPL1
Estramustine SCHEMBL6353316 0.97 RECQL (1.00) RECQLBLMESR1ADORA3INPPL1
Estramustine SCHEMBL29349776 0.97 RECQL (1.00) RECQLBLMESR1ADORA3INPPL1
Estramustine SCHEMBL29374661 0.97 RECQL (1.00) RECQLBLMESR1ADORA3INPPL1
Estramustine SCHEMBL4252 0.97 RECQL (1.00) 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 5973 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260083840-A1 METHODS FOR ABLATING MYELOID DERIVED SUPPRESSOR CELLS USING NEO-201 ANTIBODY PREC BIOLOGICS INC (US) 2026-03-26 US claimed
EP-4680284-A2 BIODEGRADABLE DENDRITIC PARTICLES FOR SUSTAINED DRUG RELEASE THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2026-01-21 EP claimed
EP-4644418-A1 NANOBODY TARGETING BCMA, CHIMERIC ANTIGEN RECEPTOR AND USE THEREOF Hebei Senlang Biotechnology Co. Ltd. (CN) 2025-11-05 EP claimed
US-20250275946-A1 COMBINATION THERAPY FOR THE TREATMENT OF CANCER UNM RAINFOREST INNOVATIONS (US) 2025-09-04 US claimed
EP-4608430-A1 TREATMENT OF PROSTATE CANCER BY PROMOTING PDE4D7 Koninklijke Philips N.V. (NL) 2025-09-03 EP claimed
US-12292443-B2 Circulating tumor cell based biomarker composition for diagnosis and prognosis of metastatic prostate cancer INJE UNIVERSITY INDUSTRY-ACADEMIC COOPERATION FOUNDATION (KR) 2025-05-06 US claimed
CN-119907692-A Isolated targeted delivery system for the treatment of gliomas 塞尔丽思股份公司 2025-04-29 CN claimed
US-20250084059-A1 CRYSTALLINE FORMS OF C21H22Cl2N4O2 BIOMED VALLEY DISCOVERIES INC (US) 2025-03-13 US claimed
CN-119403836-A Methods for eliminating myeloid-derived suppressor cells using NEO-201 antibodies 精密生物制品股份有限公司 2025-02-07 CN claimed
EP-4499710-A1 METHODS FOR ABLATING MYELOID DERIVED SUPPRESSOR CELLS USING NEO-201 ANTIBODY Precision Biologics, Inc. (US) 2025-02-05 EP claimed
US-5795882-A Method of treating prostatic diseases using delayed and/or sustained release vitamin D formulations BONE CARE INTERNATIONAL, INC. (US) 1998-08-18 US claimed
WO-1998029123-A1 METHOD OF TREATING PROSTATIC DISEASES USING ACTIVE VITAMIN D ANALOGUES BONE CARE INTERNATIONAL, INC. (US) 1998-07-09 WO claimed
WO-1998029105-A2 METHOD OF TREATING PROSTATIC DISEASES USING DELAYED AND/OR SUSTAINED RELEASE VITAMIN D FORMULATIONS BONE CARE INTERNATIONAL, INC. (US) 1998-07-09 WO claimed
WO-1998029110-A2 FORMULATION AND METHOD FOR TREATING NEOPLASMS BY INHALATION BATTELLE MEMORIAL INSTITUTE (US) 1998-07-09 WO claimed
US-5763429-A Method of treating prostatic diseases using active vitamin D analogues BONE CARE INTERNATIONAL, INC. (US) 1998-06-09 US claimed
CN-1170346-A Process for encapsulation of caplets in capsule and solid dasage forms obtainable by such process WARNER LAMBERT CO (US) 1998-01-14 CN claimed
EP-0392745-B1 Immunoconjugates and prodrugs and their use in association for drug delivery CELLTECH LTD (GB) 1994-11-02 EP claimed
EP-0120907-A1 PHARMACEUTICAL PREPARATIONS FOR USE IN ANTITUMOUR THERAPY Aston Molecules Limited (GB) 1984-10-10 EP claimed
WO-1984001506-A1 PHARMACEUTICAL PREPARATIONS FOR USE IN ANTITUMOUR THERAPY UNIV BIRMINGHAM (GB) 1984-04-26 WO 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