SCHEMBL8926928

SCHEMBL8926928

C/C(=C1/C(C)C[C@H]2[C@@H]3CC[C@H]4N(C)C(=O)CC[C@]4(C)[C@H]3CC[C@]12C)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SRD5A1 P18405 5/20 0.57
SRD5A2 P31213 2/20 0.57

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
SCHEMBL8766059 0.84 SRD5A1 (0.60) SRD5A1SRD5A2
SCHEMBL8542942 0.84 SRD5A1 (0.60) SRD5A1SRD5A2
SCHEMBL7897451 0.81 HSD17B7 (0.56) SRD5A1SRD5A2
SCHEMBL8926708 0.81 HSD17B7 (0.56) SRD5A1SRD5A2
SCHEMBL8926994 0.76 SRD5A1 (0.49) SRD5A1SRD5A2
SCHEMBL8927001 0.76 SRD5A1 (0.49) SRD5A1SRD5A2
SCHEMBL8908656 0.74 SRD5A1 (0.66) SRD5A1SRD5A2
SCHEMBL8726678 0.73 SRD5A1 (0.64) SRD5A1SRD5A2
SCHEMBL8726672 0.73 SRD5A1 (0.64) SRD5A1SRD5A2
SCHEMBL916443 0.73 SRD5A1 (0.56) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5693809-A PREGNANES FOR TREATING ALOPECIA, ACNE AND SKIN DISORDER MERCK & CO., INC. (US) 1997-12-02 US disclosed
WO-1993023039-A1 SUBSTITUTED 4-AZA-5A-ANDROSTAN-ONES AS 5A-REDUCTASE INHIBITORS MERCK & CO., INC. (US) 1993-11-25 WO disclosed