SCHEMBL14468211

SCHEMBL14468211

Cc1cc2ccc(CCCCCCC(C)c3cccc(C#N)c3)cc2cc1C

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 18/20 0.40
CNR2 P34972 15/20 0.40
HRH3 Q9Y5N1 1/20 0.38
S1PR1 P21453 1/20 0.36

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
SCHEMBL25086538 0.76 CNR1 (0.45) CNR1CNR2S1PR1
SCHEMBL14468209 0.75 CNR1 (0.40) CNR1CNR2S1PR1
SCHEMBL22432045 0.73 CNR1 (0.46) CNR1CNR2S1PR1
SCHEMBL18468484 0.71 GLA (0.43) CNR1CNR2
SCHEMBL17448761 0.71 HRH3 (0.50) HRH3
SCHEMBL5545605 0.70 CNR1 (0.43) CNR1CNR2S1PR1
SCHEMBL18970401 0.70 S1PR1 (0.45) CNR1CNR2S1PR1
SCHEMBL7408379 0.69 GRIN2D (0.55) HRH3
SCHEMBL29732423 0.68 HTR2B (0.49) CNR1HRH3
SCHEMBL24358855 0.68 HTR2B (0.49) CNR1HRH3

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-7238832-B2 Production method of a coupling compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-07-03 US disclosed