SCHEMBL8566820

SCHEMBL8566820

CCc1cn(-c2cccc(C(F)(F)F)c2)/c(=N\C(=O)O)o1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 3/20 0.40
BRD9 Q9H8M2 1/20 0.38
SCN2B O60939 2/20 0.38
SCN1B Q07699 2/20 0.38
SCN5A Q14524 2/20 0.38
SCN9A Q15858 2/20 0.38
HTT P42858 1/20 0.38
TNF P01375 2/20 0.38
ALKBH5 Q6P6C2 1/20 0.38
POLB P06746 2/20 0.38
TNFSF11 O14788 1/20 0.37
ALDH1A1 P00352 1/20 0.37
SCN1A P35498 1/20 0.37
MAPT P10636 1/20 0.36
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 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
SCHEMBL8566821 1.00 NOTUM (0.40) NOTUMBRD9SCN2BSCN1BSCN5A
SCHEMBL8600287 0.89 SCN2B (0.39) NOTUMBRD9SCN2BSCN1BSCN5A
SCHEMBL8600285 0.89 SCN2B (0.39) NOTUMBRD9SCN2BSCN1BSCN5A
SCHEMBL8568280 0.87 LMNA (0.42) NOTUMBRD9SCN2BSCN1BSCN5A
SCHEMBL8568283 0.87 LMNA (0.42) NOTUMBRD9SCN2BSCN1BSCN5A
SCHEMBL8570767 0.85 NOTUM (0.45) NOTUMSCN2BSCN1BSCN5ASCN9A
SCHEMBL8570769 0.85 NOTUM (0.45) NOTUMSCN2BSCN1BSCN5ASCN9A
SCHEMBL8570049 0.77 HTT (0.41) NOTUMBRD9HTTALDH1A1MAPT
SCHEMBL4852106 0.71 NOTUM (0.46) NOTUMSCN2BSCN1BSCN5ASCN9A
SCHEMBL4852112 0.71 NOTUM (0.46) NOTUMSCN2BSCN1BSCN5ASCN9A

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
WO-1998000408-A1 N-PHENYLIMINO HETEROCYCLIC DERIVATIVES AND THEIR USE AS HERBICIDES NOVARTIS AG (CH) 1998-01-08 WO disclosed