SCHEMBL1415233

SCHEMBL1415233

CCN1CCN(Cc2ccc(NC(=O)Cc3ccc(-n4cnc5cccnc54)cc3Cl)cc2C(F)(F)F)CC1.CN(C)CCCN(C)c1ccc(NC(=O)Cc2ccc(-n3cnc4cccnc43)cc2Cl)cc1C(F)(F)F

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MKNK2 Q9HBH9 11/20 0.45
MKNK1 Q9BUB5 8/20 0.45
ABL1 P00519 7/20 0.45
BCR P11274 5/20 0.45
CYP3A4 P08684 1/20 0.42
RET P07949 4/20 0.41
KDR P35968 3/20 0.40
PDGFRB P09619 1/20 0.40
KIT P10721 1/20 0.40
PDGFRA P16234 1/20 0.40
FGFR2 P21802 1/20 0.40
FLT3 P36888 1/20 0.40
SRC P12931 2/20 0.40
MAPK1 P28482 1/20 0.39
HTT P42858 1/20 0.39
ATM Q13315 1/20 0.39

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
SCHEMBL1408559 0.92 KCNJ5 (0.41) RETKDR
SCHEMBL1408518 0.91 MKNK2 (0.52) MKNK2MKNK1ABL1BCRCYP3A4
SCHEMBL4718201 0.88 ABL1 (0.41) ABL1RETKDRKITSRC
SCHEMBL1408285 0.86 SRC (0.53) ABL1RETKITSRC
SCHEMBL2203870 0.85 ABL1 (0.44) MKNK2MKNK1ABL1BCRRET
SCHEMBL1408098 0.84 ABL1 (0.44) MKNK2MKNK1ABL1BCRRET
SCHEMBL1414442 0.84 MKNK2 (0.53) MKNK2MKNK1ABL1BCRCYP3A4
SCHEMBL1407966 0.82 MKNK2 (0.63) MKNK2MKNK1ABL1BCRCYP3A4
SCHEMBL2202884 0.82 MKNK2 (0.42) MKNK2MKNK1ABL1BCRRET
SCHEMBL2199413 0.81 KCNJ5 (0.44) MKNK2MKNK1ABL1BCRRET

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-1874770-B1 PHENYLACETAMIDES SUITABLE AS PROTEIN KINASE INHIBITORS NOVARTIS AG (CH) 2011-03-09 EP claimed