SCHEMBL8092260

SCHEMBL8092260

COc1ccccc1C1=CC[C@H]2[C@@H]3[C@@H](C)C[C@H]4N(C)C(=O)CC[C@]4(C)[C@H]3CC[C@]12C

nearest known ligand 0.49

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SRD5A1 P18405 13/20 0.45
SRD5A2 P31213 9/20 0.45

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
SCHEMBL8092265 1.00 SRD5A1 (0.45) SRD5A1SRD5A2
SCHEMBL8097142 0.85 SRD5A1 (0.45) SRD5A1SRD5A2
SCHEMBL8092240 0.85 SRD5A1 (0.45) SRD5A1SRD5A2
SCHEMBL8084004 0.85 SRD5A1 (0.49) SRD5A1SRD5A2
SCHEMBL8084007 0.85 SRD5A1 (0.49) SRD5A1SRD5A2
SCHEMBL8084050 0.83 SRD5A1 (0.47) SRD5A1SRD5A2
SCHEMBL8084051 0.83 SRD5A1 (0.47) SRD5A1SRD5A2
SCHEMBL8096723 0.83 SRD5A1 (0.47) SRD5A1SRD5A2
SCHEMBL8096720 0.83 SRD5A1 (0.47) SRD5A1SRD5A2
SCHEMBL8090963 0.80 SRD5A1 (0.51) 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
EP-0756481-B1 17$g(b)-ARYL-4-AZA-STEROID DERIVATIVES MERCK & CO INC (US) 2000-12-27 EP claimed