SCHEMBL8631329

SCHEMBL8631329

COc1ccccc1C(C)(C)NC(=O)[C@H]1CC[C@H]2[C@@H]3CC=C4C=C(C=O)CC[C@]4(C)[C@H]3CC[C@]12C

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 12/20 0.57
SRD5A1 P18405 6/20 0.57
ESR1 P03372 1/20 0.40
AR P10275 1/20 0.40
ESR2 Q92731 1/20 0.40

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
SCHEMBL8634419 0.89 SRD5A2 (0.72) SRD5A2SRD5A1
SCHEMBL8630677 0.89 SRD5A2 (0.72) SRD5A2SRD5A1
SCHEMBL8633572 0.88 SRD5A2 (0.57) SRD5A2SRD5A1
SCHEMBL8915576 0.88 SRD5A2 (0.57) SRD5A2SRD5A1
SCHEMBL8631057 0.86 SRD5A2 (0.57) SRD5A2SRD5A1ESR1ARESR2
SCHEMBL8634498 0.84 SRD5A2 (0.78) SRD5A2SRD5A1
SCHEMBL9022014 0.81 SRD5A2 (0.50) SRD5A2SRD5A1
SCHEMBL9022016 0.81 SRD5A2 (0.50) SRD5A2SRD5A1
SCHEMBL8662715 0.81 SRD5A2 (0.53) SRD5A2SRD5A1ESR1ARESR2
SCHEMBL8913593 0.77 SRD5A2 (0.80) SRD5A2SRD5A1

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5760025-A ADMINISTERING TESTOSTERONE 5A-REDUCTASE INHIBITORS SANKYO COMPANY, LIMITED (JP) 1998-06-02 US disclosed
US-5717088-A REACTING WITH A CYANOPHOSPHATE IN THE PRESENCE OF AN ALKALI METAL CYANIDE SANKYO COMPANY, LIMITED (JP) 1998-02-10 US disclosed
US-5698720-A INTERMEDIATES FOR TESTOSTERONE 5-ALPHA-REDUCTASE INHIBITORS SANKYO COMPANY, LIMITED (JP) 1997-12-16 US disclosed
EP-0567271-B1 Steroid derivatives for the treatment of prostatic hypertrophy, their preparation and uses SANKYO CO (JP) 1997-07-02 EP disclosed
EP-0725074-A2 Compounds suitable for use as intermediates in the preparation of Androst-3,5-dien-3-carboxy derivatives SANKYO COMPANY LIMITED (JP) 1996-08-07 EP disclosed
US-5536714-A Steroid derivatives for the treatment of prostatic hypertrophy their preparation and uses SANKYO COMPANY, LIMITED (JP) 1996-07-16 US disclosed
EP-0567271-A2 Steroid derivatives for the treatment of prostatic hypertrophy, their preparation and uses SANKYO COMPANY LIMITED (JP) 1993-10-27 EP disclosed