SCHEMBL8939865

SCHEMBL8939865

CN1C(=O)CC[C@@]2(C)C1CC(=O)[C@@H]1[C@H]2CC[C@]2(C)CCC[C@@H]12

nearest known ligand 0.44

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SRD5A1 P18405 1/20 0.40
SRD5A2 P31213 1/20 0.40

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
SCHEMBL7527164 0.80 SRD5A1 (0.58) SRD5A1SRD5A2
SCHEMBL7802581 0.80 SRD5A1 (0.58) SRD5A1SRD5A2
SCHEMBL8016779 0.77 SRD5A1 (0.53) SRD5A1SRD5A2
SCHEMBL8016774 0.77 SRD5A1 (0.53) SRD5A1SRD5A2
SCHEMBL9005680 0.77 SRD5A1 (0.56) SRD5A1SRD5A2
SCHEMBL9005677 0.77 SRD5A1 (0.56) SRD5A1SRD5A2
SCHEMBL5069375 0.76 SRD5A1 (0.43) SRD5A1SRD5A2
SCHEMBL5069369 0.76 SRD5A1 (0.43) SRD5A1SRD5A2
SCHEMBL10503827 0.75 TDP1 (0.52)
SCHEMBL10503820 0.75 TDP1 (0.52)

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-0700291-A4 15-SUBSTITUTED 4-AZASTEROIDS MERCK & CO INC (US) 1996-07-03 EP disclosed
EP-0700291-A1 15-SUBSTITUTED 4-AZASTEROIDS MERCK & CO. INC. (US) 1996-03-13 EP disclosed