SCHEMBL9205367

SCHEMBL9205367

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

nearest known ligand 0.81

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 4/20 0.62
SRD5A1 P18405 3/20 0.62
AR P10275 1/20 0.62
LMNA P02545 2/20 0.55
CYP3A4 P08684 2/20 0.55
CYP2C9 P11712 2/20 0.55
CYP2C19 P33261 2/20 0.55
ABCC4 O15439 1/20 0.55
ABCB11 O95342 1/20 0.55
ADORA3 P0DMS8 1/20 0.55
CHRM1 P11229 1/20 0.55
HSD3B1 P14060 1/20 0.55
NFKB1 P19838 1/20 0.55
MAPK1 P28482 1/20 0.55
THPO P40225 1/20 0.55
BLM P54132 1/20 0.55

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
SCHEMBL9205376 1.00 SRD5A2 (0.62) SRD5A2SRD5A1ARLMNACYP3A4
SCHEMBL9215700 0.90 SRD5A2 (0.64) SRD5A2SRD5A1ARLMNACYP3A4
SCHEMBL9215708 0.90 SRD5A2 (0.64) SRD5A2SRD5A1ARLMNACYP3A4
SCHEMBL26155447 0.90 SRD5A2 (0.68) SRD5A2SRD5A1ARLMNACYP3A4
SCHEMBL5699657 0.90 SRD5A2 (0.68) SRD5A2SRD5A1ARLMNACYP3A4
SCHEMBL14506163 0.90 SRD5A2 (0.68) SRD5A2SRD5A1ARLMNACYP3A4
SCHEMBL5699698 0.90 SRD5A2 (0.68) SRD5A2SRD5A1ARLMNACYP3A4
SCHEMBL4019993 0.90 SRD5A2 (0.68) SRD5A2SRD5A1ARLMNACYP3A4
SCHEMBL4019990 0.90 SRD5A2 (0.68) SRD5A2SRD5A1ARLMNACYP3A4
SCHEMBL9212370 0.83 SRD5A2 (0.58) SRD5A2SRD5A1AR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0468012-B1 17$g(b)-SUBSTITUTED-4-AZA-5$g(a)-ANDROSTAN-3-ONE DERIVATIVES AND PROCESS FOR THEIR PREPARATION PHARMACIA SPA (IT) 1995-09-20 EP claimed
EP-0468012-A1 17-g(b)-SUBSTITUTED-4-AZA-5-g(a)-ANDROSTAN-3-ONE DERIVATIVES AND PROCESS FOR THEIR PREPARATION. ERBA CARLO SPA (IT) 1992-01-29 EP claimed
EP-0468012-B1 17$g(b)-SUBSTITUTED-4-AZA-5$g(a)-ANDROSTAN-3-ONE DERIVATIVES AND PROCESS FOR THEIR PREPARATION PHARMACIA SPA (IT) 1995-09-20 EP disclosed
US-5155107-A Inhibiting androgen action, anticarcinogenic agents, treating skin disorders, baldness FARMITALIA CARLO ERBA (IT) 1992-10-13 US disclosed
EP-0468012-A1 17-g(b)-SUBSTITUTED-4-AZA-5-g(a)-ANDROSTAN-3-ONE DERIVATIVES AND PROCESS FOR THEIR PREPARATION. ERBA CARLO SPA (IT) 1992-01-29 EP disclosed