SCHEMBL3940458

SCHEMBL3940458

Cc1ccc(NC(=O)c2cccn2C)cc1C(=O)Nc1cccnc1

nearest known ligand 0.63

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BRAF P15056 14/20 0.63
CSF1R P07333 3/20 0.58
CYP11B2 P19099 1/20 0.55
NAMPT P43490 1/20 0.54
KIT P10721 1/20 0.53
KDR P35968 1/20 0.53
MAPK14 Q16539 1/20 0.53
ROCK2 O75116 1/20 0.53
POLB P06746 1/20 0.53
MAPT P10636 1/20 0.53
RECQL P46063 1/20 0.53
CTDSP1 Q9GZU7 1/20 0.53
TDP1 Q9NUW8 1/20 0.53

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
SCHEMBL3934814 0.86 BRAF (0.62) BRAFCSF1RCYP11B2NAMPTKIT
SCHEMBL3943800 0.82 BRAF (0.80) BRAFCSF1RCYP11B2NAMPT
SCHEMBL3932898 0.81 BRAF (0.59) BRAFCSF1RCYP11B2NAMPTKIT
SCHEMBL3937474 0.81 BRAF (0.59) BRAFCSF1RCYP11B2KITKDR
SCHEMBL27720496 0.80 BRAF (0.55) BRAFCSF1RCYP11B2NAMPTKIT
SCHEMBL3934068 0.79 BRAF (0.65) BRAFCSF1RNAMPTKITKDR
SCHEMBL3941714 0.79 BRAF (0.83) BRAFCSF1RKITKDRMAPK14
SCHEMBL3937724 0.79 CSF1R (0.83) BRAFCSF1RCYP11B2KITKDR
SCHEMBL27720411 0.78 CYP11B2 (0.76) BRAFCSF1RCYP11B2
SCHEMBL27720477 0.78 BRAF (0.58) BRAFCSF1RCYP11B2KITKDR

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
EP-1831198-B1 PYRIDINE CARBOXAMIDE DERIVATIVES FOR USE AS ANTICANCER AGENTS ASTRAZENECA AB (SE) 2009-04-08 EP disclosed