SCHEMBL3934255

SCHEMBL3934255

Cc1ccc(NC(=O)c2cccc(C(C)(C)C)c2)cc1C(=O)Nc1cccnc1

nearest known ligand 0.83

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BRAF P15056 16/20 0.83
CSF1R P07333 4/20 0.83
KIT P10721 2/20 0.71
MAPK14 Q16539 2/20 0.71
KDR P35968 1/20 0.71
ABL1 P00519 1/20 0.66
LCK P06239 1/20 0.66
SRC P12931 1/20 0.66
CYP2C9 P11712 2/20 0.63

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
SCHEMBL3936166 0.92 BRAF (0.86) BRAFCSF1RKITMAPK14KDR
SCHEMBL1276318 0.91 BRAF (1.00) BRAFCSF1RKITMAPK14KDR
SCHEMBL3937762 0.89 BRAF (0.82) BRAFCSF1RKITMAPK14KDR
SCHEMBL3934672 0.89 BRAF (1.00) BRAFCSF1RCYP2C9
SCHEMBL3943781 0.89 BRAF (0.82) BRAFCSF1RKITMAPK14KDR
SCHEMBL16881794 0.89 NPC1 (0.75) BRAFCSF1RKITMAPK14KDR
SCHEMBL3932667 0.87 BRAF (0.73) BRAFCSF1RKITMAPK14KDR
SCHEMBL3937779 0.87 BRAF (1.00) BRAFCSF1RKITMAPK14KDR
SCHEMBL3935822 0.86 BRAF (0.72) BRAFCSF1RKITMAPK14KDR
SCHEMBL3945794 0.85 BRAF (0.80) BRAFCSF1RKITMAPK14KDR

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-1831198-B1 PYRIDINE CARBOXAMIDE DERIVATIVES FOR USE AS ANTICANCER AGENTS ASTRAZENECA AB (SE) 2009-04-08 EP disclosed
CN-101128454-A Pyridine carboxamide derivatives for use as anticancer agents ASTRAZENECA AB (SE) 2008-02-20 CN disclosed