SCHEMBL8424559

SCHEMBL8424559

CCc1cn(-c2cccc(C(F)(F)F)c2)c(=NC(=O)C(F)F)s1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 7/20 0.40
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
KARS1 Q15046 1/20 0.37
BRD9 Q9H8M2 1/20 0.36
HTT P42858 1/20 0.36
CNR1 P21554 2/20 0.36
NOTUM Q6P988 1/20 0.36
TNFSF11 O14788 1/20 0.36
TNF P01375 1/20 0.36
POLB P06746 1/20 0.35
ALDH1A1 P00352 1/20 0.35
SCN2B O60939 2/20 0.35
SCN1B Q07699 2/20 0.35
SCN5A Q14524 2/20 0.35
SCN9A Q15858 2/20 0.35
SCN1A P35498 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL8424301 0.93 CNR2 (0.39) CNR2CYP1A2CYP2C9CYP2C19NPSR1
SCHEMBL8424057 0.92 CNR2 (0.39) CNR2CYP1A2CYP2C9CYP2C19NPSR1
SCHEMBL8423928 0.91 CNR2 (0.40) CNR2CYP1A2CYP2C9CYP2C19NPSR1
SCHEMBL8424239 0.86 CNR2 (0.44) CNR2CYP1A2CYP2C9CYP2C19NPSR1
SCHEMBL9064603 0.85 CNR2 (0.39) CNR2CYP1A2CYP2C9CYP2C19NPSR1
SCHEMBL8425557 0.84 MAPT (0.40) CNR2NPSR1HTTNOTUMTNFSF11
SCHEMBL8425465 0.84 CNR2 (0.40) CNR2NPSR1HTTNOTUMTNFSF11
SCHEMBL9064114 0.83 CNR2 (0.41) CNR2CYP1A2CYP2C9CYP2C19NPSR1
SCHEMBL8425725 0.78 CNR2 (0.43) CNR2CYP1A2CYP2C9CYP2C19NPSR1
SCHEMBL8428409 0.77 CNR2 (0.43) CNR2CYP1A2CYP2C9CYP2C19NPSR1

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
EP-0636616-B1 Process for production of fluoroalkanecarboxamide derivatives SUMITOMO CHEMICAL CO (JP) 1999-10-27 EP disclosed
US-5484933-A Process for production of fluoroalkane carboxamide derivatives SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-01-16 US disclosed
EP-0636616-A1 Process for production of fluoroalkanecarboxamide derivatives SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1995-02-01 EP disclosed