SCHEMBL24348474

SCHEMBL24348474

CC(=N)/C=C(\O)c1cnc(NCc2cccc(F)c2)nc1C(F)(F)F

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 13/20 0.49
PTK2 Q05397 1/20 0.42
CCNE2 O96020 1/20 0.41
CCNE1 P24864 1/20 0.41
CDK2 P24941 1/20 0.41
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
NTRK1 P04629 2/20 0.39
JAK2 O60674 1/20 0.39
JAK1 P23458 1/20 0.39
JAK3 P52333 1/20 0.39
APP P05067 1/20 0.38
CXCR4 P61073 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
SCHEMBL24349015 0.79 VNN1 (0.37) CNR2PTK2CYP1A2CYP3A4CYP2D6
SCHEMBL24348350 0.69 HDAC6 (0.42) CNR2PTK2CCNE2CCNE1CDK2
SCHEMBL24348347 0.68 MAPK1 (0.42) CNR2CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL24348342 0.67 IGF1R (0.44) CCNE1CDK2JAK2JAK3
SCHEMBL25934296 0.66 GAA (0.51) PTK2CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL5077160 0.66 CNR2 (1.00) CNR2CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL4894731 0.66 CNR2 (0.67) CNR2CDK2CYP1A2CYP3A4CYP2D6
SCHEMBL22191429 0.65 GAA (0.52) PTK2CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL5781933 0.64 CNR2 (0.69) CNR2CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL3378853 0.64 CNR2 (0.72) CNR2CDK2CYP1A2CYP3A4CYP2D6

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-2022053803-A1 HERBICIDAL PYRIMIDINE DERIVATIVES MOA Technology Limited (GB) 2022-03-17 WO disclosed