SCHEMBL14468209

SCHEMBL14468209

CC(CCCCCCI)c1cccc(C#N)c1

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 18/20 0.40
CNR2 P34972 13/20 0.40
GLA P06280 1/20 0.38
S1PR1 P21453 1/20 0.38

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 0.87 CNR1 (0.45) CNR1CNR2GLAS1PR1
SCHEMBL22432045 0.83 CNR1 (0.46) CNR1CNR2GLAS1PR1
SCHEMBL18970401 0.80 S1PR1 (0.45) CNR1CNR2GLAS1PR1
SCHEMBL5545605 0.80 CNR1 (0.43) CNR1CNR2GLAS1PR1
SCHEMBL23059552 0.76 KCNA5 (0.51) CNR1CNR2
SCHEMBL825570 0.76 HDAC4 (0.49) CNR1CNR2GLAS1PR1
SCHEMBL14445672 0.76 RIPK1 (0.50)
SCHEMBL14468211 0.75 CNR1 (0.40) CNR1CNR2S1PR1
SCHEMBL13159690 0.74 S1PR1 (0.47) CNR1CNR2GLAS1PR1
SCHEMBL12302870 0.74 CNR1 (0.44) CNR1CNR2GLAS1PR1

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