SCHEMBL9308541

SCHEMBL9308541

C[C@]12CCC(=O)N[C@@H]1CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](C(=O)Cl)CC[C@@H]12

nearest known ligand 0.80

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 4/20 0.72
SRD5A1 P18405 3/20 0.66
AR P10275 1/20 0.66
AKR1B10 O60218 1/20 0.48
AKR1B1 P15121 1/20 0.48
GPBAR1 Q8TDU6 1/20 0.48

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
SCHEMBL12423998 0.89 SRD5A2 (0.73) SRD5A2SRD5A1AR
SCHEMBL14477862 0.89 SRD5A2 (0.73) SRD5A2SRD5A1ARAKR1B10AKR1B1
SCHEMBL14397354 0.89 SRD5A2 (0.73) SRD5A2SRD5A1AR
SCHEMBL950693 0.89 SRD5A2 (0.73) SRD5A2SRD5A1AR
SCHEMBL14477867 0.89 SRD5A2 (0.73) SRD5A2SRD5A1AR
SCHEMBL5907001 0.89 SRD5A2 (0.73) SRD5A2SRD5A1AR
SCHEMBL13844000 0.89 SRD5A2 (0.73) SRD5A2SRD5A1AR
SCHEMBL28559933 0.89 SRD5A2 (0.73) SRD5A2SRD5A1ARAKR1B10AKR1B1
SCHEMBL950691 0.89 SRD5A2 (0.73) SRD5A2SRD5A1AR
SCHEMBL14360068 0.89 SRD5A2 (0.73) SRD5A2SRD5A1ARAKR1B10AKR1B1

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
WO-1994022900-A1 AZA-ANDROSTANE-17β-CARBOXAMIDES CIBA-GEIGY AG (CH) 1994-10-13 WO disclosed
US-5304562-A Inhibitors of 5-alpha-reductase; treating prostate disorders CIBA-GEIGY CORPORATION (US) 1994-04-19 US disclosed