SCHEMBL8927210

SCHEMBL8927210

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 1)

geneUniProtsupporting neighboursconfidence
SRD5A1 P18405 1/20 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
SCHEMBL8927179 1.00 SRD5A1 (0.57) SRD5A1
SCHEMBL8927213 1.00 SRD5A1 (0.57) SRD5A1
SCHEMBL8925120 1.00 SRD5A1 (0.57) SRD5A1
SCHEMBL9546871 1.00 SRD5A1 (0.57) SRD5A1
SCHEMBL8925124 1.00 SRD5A1 (0.57) SRD5A1
SCHEMBL8926974 0.90 SRD5A1 (0.56) SRD5A1
SCHEMBL8926968 0.90 SRD5A1 (0.56) SRD5A1
SCHEMBL8926979 0.90 SRD5A1 (0.56) SRD5A1
SCHEMBL8924955 0.88 SRD5A1 (0.54) SRD5A1
SCHEMBL8924959 0.88 SRD5A1 (0.54) 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