SCHEMBL6614352

SCHEMBL6614352

CC(=O)Nc1c(F)c(-c2ccc(Cl)cc2Cl)nc(C(=O)O)c1Cl

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 16/20 0.45
CNR2 P34972 12/20 0.45
EGFR P00533 1/20 0.44
ALOX5 P09917 1/20 0.44
ADORA3 P0DMS8 1/20 0.44
GABRA1 P14867 1/20 0.44
ADRA2C P18825 1/20 0.44
MAPK3 P27361 1/20 0.44
OPRL1 P41146 1/20 0.44
SLC6A3 Q01959 1/20 0.44
SLC18A2 Q05940 1/20 0.44
MAPK14 Q16539 1/20 0.44
TMEM97 Q5BJF2 1/20 0.44
SIGMAR1 Q99720 1/20 0.44
KDM4E B2RXH2 2/20 0.42
HSD17B10 Q99714 1/20 0.42
CFTR P13569 1/20 0.40
SCN9A Q15858 1/20 0.40
SCN2A Q99250 1/20 0.40
SCN3A Q9NY46 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
SCHEMBL2467013 0.89 CNR1 (0.46) CNR1CNR2EGFRALOX5ADORA3
SCHEMBL2469857 0.79 TDP1 (0.42) CNR1CNR2CFTR
SCHEMBL2465707 0.75 CNR1 (0.41) CNR1CNR2CFTR
SCHEMBL6164151 0.75 ALDH1A1 (0.43) CNR1CNR2ADORA3KDM4EHSD17B10
SCHEMBL15440532 0.73 CNR1 (0.38) CNR1CNR2ADORA3KDM4EKMT2A
SCHEMBL2465128 0.71 ALPL (0.44) CNR1CNR2SLC6A3KDM4ECFTR
SCHEMBL27838081 0.70 KMO (0.39) CNR1KDM4E
SCHEMBL9938756 0.69 TDP1 (0.42) CFTR
SCHEMBL3364045 0.69 CNR1 (0.48) CNR1CNR2EGFRALOX5ADORA3
SCHEMBL2466315 0.69 KMO (0.46) MAPK1

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-1414814-A1 6-ARYL-4-AMINOPICOLINATES AND THEIR USE AS HERBICIDES Dow Agrosciences LLC (US) 2004-05-06 EP disclosed
WO-2003011853-A1 6-ARYL-4-AMINOPICOLINATES AND THEIR USE AS HERBICIDES DOW AGROSCIENCES LLC (US) 2003-02-13 WO disclosed