SCHEMBL9023091

SCHEMBL9023091

Cc1ccc(CC(NC(=O)O[C@H]2CC[C@H]3[C@@H]4CC=C5NC(=O)CC[C@]5(C)[C@H]4CC[C@]23C)c2ccccc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SRD5A1 P18405 3/20 0.45
SRD5A2 P31213 11/20 0.40
CYP3A4 P08684 2/20 0.36
NR1I2 O75469 2/20 0.36
LMNA P02545 1/20 0.36
NR3C1 P04150 1/20 0.36
CYP17A1 P05093 1/20 0.36
PGR P06401 1/20 0.36
AR P10275 1/20 0.36
CYP2C9 P11712 1/20 0.36
TSHR P16473 1/20 0.36
CYP2C19 P33261 1/20 0.36
OPRK1 P41145 1/20 0.36
MAPT P10636 1/20 0.36
STS P08842 1/20 0.36
CYP19A1 P11511 2/20 0.36

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
SCHEMBL9022128 0.96 SRD5A1 (0.47) SRD5A1SRD5A2CYP3A4NR1I2LMNA
SCHEMBL9022308 0.87 SRD5A2 (0.53) SRD5A1SRD5A2AR
SCHEMBL9022314 0.87 SRD5A2 (0.53) SRD5A1SRD5A2AR
SCHEMBL9022678 0.87 SRD5A2 (0.53) SRD5A1SRD5A2AR
SCHEMBL9022685 0.87 SRD5A2 (0.53) SRD5A1SRD5A2AR
SCHEMBL9023005 0.86 SRD5A2 (0.51) SRD5A1SRD5A2CYP3A4NR1I2LMNA
SCHEMBL9022566 0.86 SRD5A1 (0.46) SRD5A1SRD5A2CYP3A4NR1I2LMNA
SCHEMBL9022563 0.83 SRD5A2 (0.51) SRD5A1SRD5A2AR
SCHEMBL9022428 0.83 SRD5A2 (0.48) SRD5A1SRD5A2CYP3A4NR1I2LMNA
SCHEMBL9022200 0.83 SRD5A2 (0.55) SRD5A1SRD5A2AR

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-0484094-B1 Azasteroid compounds for the treatment of prostatic hypertrophy, their preparation and use SANKYO CO (JP) 1996-06-26 EP claimed