SCHEMBL13610942

SCHEMBL13610942

CC1=C2N(C)C(=O)CCC2(C)C2CCC3(C)C(C(=O)O)CCC3C2C1

nearest known ligand 0.52

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 8/20 0.48
SRD5A1 P18405 4/20 0.46

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
SCHEMBL13611175 1.00 SRD5A2 (0.48) SRD5A2SRD5A1
SCHEMBL4011728 1.00 SRD5A2 (0.48) SRD5A2SRD5A1
SCHEMBL4011724 1.00 SRD5A2 (0.48) SRD5A2SRD5A1
SCHEMBL13603576 1.00 SRD5A2 (0.48) SRD5A2SRD5A1
SCHEMBL13603457 1.00 SRD5A2 (0.48) SRD5A2SRD5A1
SCHEMBL4007234 0.89 SRD5A2 (0.52) SRD5A2SRD5A1
SCHEMBL4007233 0.89 SRD5A2 (0.52) SRD5A2SRD5A1
SCHEMBL14214662 0.89 SRD5A2 (0.52) SRD5A2SRD5A1
SCHEMBL13603455 0.89 SRD5A2 (0.52) SRD5A2SRD5A1
SCHEMBL14185015 0.88 SRD5A2 (0.43) SRD5A2SRD5A1

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-7625919-B2 4-azasteroid derivatives as androgen receptor modulators MERCK & CO., INC. (US) 2009-12-01 US disclosed