SCHEMBL8409012

SCHEMBL8409012

CC(=O)[C@H]1[C@@H](C)C[C@H]2[C@@H]3CC[C@@H]4N(C)C(=O)CC[C@]4(C)[C@H]3CC[C@@]21C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SRD5A1 P18405 1/20 0.56
SRD5A2 P31213 1/20 0.56

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
SCHEMBL9546878 1.00 SRD5A1 (0.56) SRD5A1SRD5A2
SCHEMBL8159481 1.00 SRD5A1 (0.56) SRD5A1SRD5A2
SCHEMBL8159479 1.00 SRD5A1 (0.56) SRD5A1SRD5A2
SCHEMBL8925190 1.00 SRD5A1 (0.56) SRD5A1SRD5A2
SCHEMBL8927166 0.88
SCHEMBL8924891 0.88 SRD5A1 (0.53) SRD5A1SRD5A2
SCHEMBL8927178 0.86
SCHEMBL8926938 0.84 SRD5A1 (0.54) SRD5A1SRD5A2
SCHEMBL8926914 0.84 SRD5A1 (0.53) SRD5A1SRD5A2
SCHEMBL8926919 0.84 SRD5A1 (0.53) SRD5A1SRD5A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5994362-A ADMINISTERING FINASTERIDE AND CASODEX MERCK & CO., INC. (US) 1999-11-30 US disclosed