SCHEMBL8925449

SCHEMBL8925449

CC1C[C@H]2[C@@H]3CCC4N(C)C(=O)CC[C@]4(C)[C@@H]3CC[C@]2(C)C1CNC(=O)Nc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SRD5A1 P18405 4/20 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
SCHEMBL8071820 0.86 SRD5A1 (0.56) SRD5A1SRD5A2
SCHEMBL8063851 0.86 SRD5A1 (0.56) SRD5A1SRD5A2
SCHEMBL8074047 0.86 SRD5A1 (0.56) SRD5A1SRD5A2
SCHEMBL8924921 0.84 SRD5A2 (0.55) SRD5A2
SCHEMBL8924927 0.84 SRD5A2 (0.55) SRD5A2
SCHEMBL8926915 0.84 SRD5A2 (0.55) SRD5A2
SCHEMBL8926790 0.84 SRD5A1 (0.52) SRD5A1SRD5A2
SCHEMBL8926910 0.84 SRD5A2 (0.55) SRD5A2
SCHEMBL8927276 0.83 SRD5A1 (0.52) SRD5A1SRD5A2
SCHEMBL8927274 0.83 SRD5A1 (0.52) 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-5693809-A PREGNANES FOR TREATING ALOPECIA, ACNE AND SKIN DISORDER MERCK & CO., INC. (US) 1997-12-02 US disclosed