SCHEMBL8552573

SCHEMBL8552573

N#Cc1cc(Oc2cccc(SC(F)(F)F)c2)nc(-c2ccc(C(F)(F)F)cc2)c1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.37
KIF11 P52732 1/20 0.37
CTSS P25774 1/20 0.37
CTSK P43235 1/20 0.37
LOXL2 Q9Y4K0 1/20 0.37
MAPK1 P28482 1/20 0.35
SCN9A Q15858 7/20 0.35
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
KCNH2 Q12809 1/20 0.34
NTRK1 P04629 1/20 0.34

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
SCHEMBL8551508 0.88 TRPV1 (0.36) TRPV1KIF11CTSSCTSKLOXL2
SCHEMBL8552758 0.87 KIF11 (0.42) TRPV1KIF11CTSSCTSKLOXL2
SCHEMBL8548872 0.87 POLB (0.43) TRPV1KIF11CTSSCTSKLOXL2
SCHEMBL8549675 0.85 ADORA1 (0.46) TRPV1KIF11CTSSCTSKLOXL2
SCHEMBL8550852 0.83 KIF11 (0.39) TRPV1KIF11CTSSCTSKLOXL2
SCHEMBL8546808 0.81 POLB (0.43) KIF11CTSSCTSKLOXL2MAPK1
SCHEMBL8552730 0.80 POLB (0.41) CTSSCTSKLOXL2NTRK1
SCHEMBL8471818 0.80 PSD (0.41) CTSSLOXL2NTRK1
SCHEMBL8553832 0.78 TRPV1 (0.43) TRPV1KIF11CTSSCTSKSCN9A
SCHEMBL8547908 0.77 POLB (0.41) CTSSCTSKLOXL2SCN9ANTRK1

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-0820996-A1 Herbicidal cyanopyridines American Cyanamid Company (US) 1998-01-28 EP claimed
EP-0820996-A1 Herbicidal cyanopyridines American Cyanamid Company (US) 1998-01-28 EP disclosed