SCHEMBL3929980

SCHEMBL3929980

Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1C(=O)Nc1ccc(C(F)(F)F)nc1

nearest known ligand 0.79

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
BTK Q06187 12/20 0.79
LCK P06239 11/20 0.79
MAPK14 Q16539 5/20 0.79
KDR P35968 4/20 0.79
CSF1R P07333 2/20 0.76
BRAF P15056 2/20 0.76
KIT P10721 4/20 0.76
ABL1 P00519 1/20 0.76
SRC P12931 1/20 0.76
CYP2C9 P11712 1/20 0.72
BLK P51451 3/20 0.69
EGFR P00533 1/20 0.66
ERBB2 P04626 1/20 0.66
TEC P42680 1/20 0.66
TXK P42681 1/20 0.66
BMX P51813 1/20 0.66
JAK3 P52333 1/20 0.66
ERBB4 Q15303 1/20 0.66

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
SCHEMBL27720455 0.89 BRAF (0.76) BTKLCKMAPK14KDRCSF1R
SCHEMBL2944882 0.88 LCK (1.00) BTKLCKMAPK14KDRCSF1R
SCHEMBL1276318 0.86 BRAF (1.00) BTKLCKMAPK14KDRCSF1R
SCHEMBL2947918 0.86 LCK (1.00) BTKLCKMAPK14KDRCSF1R
SCHEMBL1276885 0.86 CSF1R (1.00) BTKLCKMAPK14KDRCSF1R
SCHEMBL3937730 0.86 BRAF (0.82) BTKLCKMAPK14KDRCSF1R
SCHEMBL27720381 0.85 BTK (0.83) BTKLCKMAPK14KDRCSF1R
SCHEMBL3939130 0.85 BTK (0.70) BTKLCKMAPK14KDRCSF1R
SCHEMBL27699869 0.84 LCK (0.81) BTKLCKMAPK14KDRCSF1R
SCHEMBL12212487 0.84 BTK (0.88) BTKLCKMAPK14KDRCSF1R

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