SCHEMBL8960005

SCHEMBL8960005

CCCCCCCC(CCCCCCC)CC(=O)c1cn(CCCC(=O)O)c2ccccc12

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 15/20 0.59
CDC25A P30304 1/20 0.53
CNR1 P21554 4/20 0.52
CREBBP Q92793 1/20 0.51

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
SCHEMBL8959848 0.88 CNR2 (0.57) CNR2CNR1CREBBP
SCHEMBL8959748 0.87 CNR2 (0.67) CNR2CDC25ACNR1CREBBP
SCHEMBL8959968 0.87 CNR2 (0.67) CNR2CDC25ACNR1CREBBP
SCHEMBL8959732 0.87 CNR2 (0.67) CNR2CDC25ACNR1CREBBP
SCHEMBL8959839 0.87 CNR2 (0.67) CNR2CDC25ACNR1CREBBP
SCHEMBL8959987 0.87 CNR2 (0.67) CNR2CDC25ACNR1CREBBP
SCHEMBL8959985 0.87 CNR2 (0.67) CNR2CDC25ACNR1CREBBP
SCHEMBL9247864 0.87 CNR2 (0.67) CNR2CDC25ACNR1CREBBP
SCHEMBL286791 0.85 CNR2 (0.72) CNR2CDC25ACNR1
SCHEMBL9251121 0.84 CNR2 (0.55) CNR2CDC25ACNR1CREBBP

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
US-5530019-A FOR TREATMENT OF PROSTATE GLAND DISORDERS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-06-25 US disclosed
EP-0648208-A1 INDOLE DERIVATIVES AS TESTOSTERONE 5 ALPHA-REDUCTASE INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-04-19 EP disclosed
WO-1994022821-A1 INDOLE DERIVATIVES AS TESTOSTERONE 5 ALPHA-REDUCTASE INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-10-13 WO disclosed