SCHEMBL9688048

SCHEMBL9688048

CC#CCC1(C(=O)O)CCC1

nearest known ligand 0.42

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.42
FFAR3 O14843 1/20 0.31

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
SCHEMBL1934586 0.96 CYP2C19 (0.47) CYP2C19FFAR3
SCHEMBL9687604 0.82 CYP2C19 (0.41) CYP2C19FFAR3
SCHEMBL9688857 0.80 CYP2C19 (0.39) CYP2C19
SCHEMBL9686990 0.79 CYP2C19 (0.38) CYP2C19
SCHEMBL9687031 0.79 CYP4F2 (0.45)
SCHEMBL27689461 0.74 CYP2C19 (0.45) CYP2C19
SCHEMBL16700278 0.74 CYP2C19 (0.45) CYP2C19
SCHEMBL11381914 0.73 CYP2C19 (0.55) CYP2C19
SCHEMBL1055977 0.70
SCHEMBL16730622 0.70

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5124343-A Carbacyclins, process for the preparation thereof, and use thereof as medicinal agents SCHERING AKTIENGESELLSCHAFT (DE) 1992-06-23 US disclosed