SCHEMBL8924937

SCHEMBL8924937

CC1C[C@H]2[C@@H]3CCC4N(C)C(=O)CC[C@]4(C)[C@H]3CC[C@]2(C)[C@H]1C(C)OC(c1ccccc1)c1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SRD5A1 P18405 5/20 0.51
SRD5A2 P31213 2/20 0.51

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
SCHEMBL8924935 1.00 SRD5A1 (0.51) SRD5A1SRD5A2
SCHEMBL8078317 0.85 SRD5A1 (0.58) SRD5A1SRD5A2
SCHEMBL8078320 0.85 SRD5A1 (0.58) SRD5A1SRD5A2
SCHEMBL8925486 0.84 SRD5A1 (0.56) SRD5A1SRD5A2
SCHEMBL8924959 0.84 SRD5A1 (0.54) SRD5A1SRD5A2
SCHEMBL8924965 0.84 SRD5A1 (0.54) SRD5A1SRD5A2
SCHEMBL8924955 0.84 SRD5A1 (0.54) SRD5A1SRD5A2
SCHEMBL8927173 0.82 SRD5A1 (0.50) SRD5A1SRD5A2
SCHEMBL8926950 0.82 SRD5A1 (0.52) SRD5A1SRD5A2
SCHEMBL8927213 0.81 SRD5A1 (0.57) SRD5A1

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