SCHEMBL9015172

SCHEMBL9015172

CC(C)N(C(=O)[C@H]1CC[C@H]2[C@@H]3CC=C4C=C(OC(=O)O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C

nearest known ligand 0.75

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 15/20 0.75
SRD5A1 P18405 2/20 0.71

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
SCHEMBL8802576 0.88 SRD5A2 (0.59) SRD5A2SRD5A1
SCHEMBL8802669 0.87 SRD5A2 (0.57) SRD5A2SRD5A1
SCHEMBL8148982 0.86 SRD5A2 (1.00) SRD5A2SRD5A1
SCHEMBL10704713 0.86 SRD5A2 (1.00) SRD5A2SRD5A1
SCHEMBL8148978 0.86 SRD5A2 (1.00) SRD5A2SRD5A1
SCHEMBL8158159 0.85 SRD5A2 (0.81) SRD5A2SRD5A1
SCHEMBL8158161 0.85 SRD5A2 (0.81) SRD5A2SRD5A1
SCHEMBL8803098 0.84 SRD5A2 (0.54) SRD5A2SRD5A1
SCHEMBL8801973 0.83 SRD5A2 (0.58) SRD5A2SRD5A1
SCHEMBL8394055 0.83 SRD5A2 (0.75) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0521080-B1 SYNERGISTIC COMPOSITIONS SMITHKLINE BEECHAM CORP (US) 1996-12-11 EP claimed
EP-0289327-B1 STEROID 5-ALPHA-REDUCTASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 1991-12-18 EP claimed