SCHEMBL14487954

SCHEMBL14487954

Cc1ccc(NC(=O)c2cccc(C=O)c2)cc1Nc1nccc(-c2cccnc2)n1

nearest known ligand 0.79

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 13/20 0.79
PDGFRA P16234 12/20 0.79
BCR P11274 8/20 0.79
PDGFRB P09619 5/20 0.79
EGFR P00533 2/20 0.79
PRKCA P17252 1/20 0.79
KIT P10721 4/20 0.72
JAK3 P52333 1/20 0.68
BTK Q06187 1/20 0.68
ITK Q08881 1/20 0.68
KDR P35968 2/20 0.68
ABL2 P42684 2/20 0.65

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
SCHEMBL2004455 0.89 PDGFRA (0.91) ABL1PDGFRABCRPDGFRBEGFR
SCHEMBL9782 0.88 PDGFRA (1.00) ABL1PDGFRABCRPDGFRBEGFR
SCHEMBL29498750 0.88 PDGFRA (1.00) ABL1PDGFRABCRPDGFRBEGFR
SCHEMBL4801110 0.88 ABL1 (0.84) ABL1PDGFRABCRPDGFRBEGFR
Methane SCHEMBL5972158 0.87 PDGFRA (0.98) ABL1PDGFRABCRPDGFRBEGFR
SCHEMBL4803263 0.86 ABL1 (0.81) ABL1PDGFRABCRPDGFRBEGFR
SCHEMBL4802851 0.86 ABL1 (0.83) ABL1PDGFRABCRPDGFRBEGFR
SCHEMBL9820 0.86 PDGFRA (1.00) ABL1PDGFRABCRPDGFRBEGFR
SCHEMBL3099865 0.85 ABL1 (0.77) ABL1PDGFRABCRPDGFRBEGFR
SCHEMBL1408815 0.85 ABL1 (0.77) ABL1PDGFRABCRPDGFRBEGFR

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
US-7232825-B2 Phenylaminopyrimidine derivatives and methods of use CHEN GUOQING P 2007-06-19 US disclosed
US-7232825-B2 Phenylaminopyrimidine derivatives and methods of use CHEN GUOQING P 2007-06-19 US disclosed