SCHEMBL9212350

SCHEMBL9212350

CC(C)NC(=S)N(C(=O)C1CC[C@H]2[C@@H]3CCC4N(C)C(=O)CC[C@]4(C)[C@@H]3CC[C@]12C)C(C)C

nearest known ligand 0.83

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 5/20 0.83
SRD5A1 P18405 1/20 0.64

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
SCHEMBL9212342 1.00 SRD5A2 (0.83) SRD5A2SRD5A1
SCHEMBL9402918 1.00 SRD5A2 (0.83) SRD5A2SRD5A1
Turosteride SCHEMBL22032591 0.91 SRD5A2 (1.00) SRD5A2SRD5A1
Turosteride SCHEMBL16412164 0.91 SRD5A2 (1.00) SRD5A2SRD5A1
Turosteride SCHEMBL9211714 0.91 SRD5A2 (1.00) SRD5A2SRD5A1
Turosteride SCHEMBL9402862 0.91 SRD5A2 (1.00) SRD5A2SRD5A1
Turosteride SCHEMBL62002 0.91 SRD5A2 (1.00) SRD5A2SRD5A1
SCHEMBL9208029 0.86 SRD5A2 (0.73) SRD5A2SRD5A1
SCHEMBL9208022 0.86 SRD5A2 (0.73) SRD5A2SRD5A1
SCHEMBL8978642 0.86 SRD5A2 (0.78) 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 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