SCHEMBL8529411

SCHEMBL8529411

CCOC(=O)N(C(=O)C1CC[C@H]2[C@@H]3CNC4=CC(=O)CC[C@]4(C)[C@@H]3CC[C@]12C)c1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 20/20 0.69
HSD3B1 P14060 1/20 0.55
SRD5A1 P18405 1/20 0.55

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
SCHEMBL8533274 0.89 SRD5A2 (0.76) SRD5A2
SCHEMBL8528413 0.87 SRD5A2 (0.73) SRD5A2
SCHEMBL8528588 0.85 SRD5A2 (0.76) SRD5A2
SCHEMBL9192543 0.83 SRD5A2 (0.71) SRD5A2
SCHEMBL9192538 0.83 SRD5A2 (0.71) SRD5A2
SCHEMBL8612618 0.83 SRD5A2 (0.82) SRD5A2
SCHEMBL8528636 0.82 SRD5A2 (0.72) SRD5A2
SCHEMBL8528578 0.82 SRD5A2 (0.76) SRD5A2
SCHEMBL8612687 0.82 SRD5A2 (1.00) SRD5A2SRD5A1
SCHEMBL8612685 0.82 SRD5A2 (1.00) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0674651-B1 SUBSTITUTED 6-AZAANDROSTENONES GLAXO WELLCOME INC (US) 1998-10-28 EP disclosed
EP-0674651-A1 SUBSTITUTED 6-AZAANDROSTENONES GLAXO WELLCOME INC. (US) 1995-10-04 EP disclosed
WO-1994014833-A2 SUBSTITUTED 6-AZAANDROSTENONES GLAXO WELLCOME INC. (US) 1994-07-07 WO disclosed