SCHEMBL9862

SCHEMBL9862

Cc1cc(NC(=O)c2ccccc2)cc(Nc2nccc(-c3cccnc3)n2)c1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 16/20 0.79
BCR P11274 16/20 0.79
PDGFRB P09619 10/20 0.79
PDGFRA P16234 10/20 0.79
PRKCA P17252 7/20 0.79
SRC P12931 5/20 0.79
PRKCD Q05655 3/20 0.79
PRKD3 O94806 1/20 0.79
PRKCG P05129 1/20 0.79
PRKCB P05771 1/20 0.79
PRKCH P24723 1/20 0.79
PRKCI P41743 1/20 0.79
PRKCE Q02156 1/20 0.79
PRKCQ Q04759 1/20 0.79
PRKCZ Q05513 1/20 0.79
PRKD1 Q15139 1/20 0.79
EGFR P00533 1/20 0.74
ABL2 P42684 1/20 0.66
JAK2 O60674 1/20 0.60
HDAC1 Q13547 1/20 0.60

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
SCHEMBL9197 0.88 ABL1 (1.00) ABL1BCRPDGFRBPDGFRAPRKCA
SCHEMBL4903275 0.87 ABL1 (0.81) ABL1BCRPDGFRBPDGFRAPRKCA
SCHEMBL9763 0.85 ABL1 (1.00) ABL1BCRPDGFRBPDGFRAPRKCA
SCHEMBL29498750 0.85 PDGFRA (1.00) ABL1BCRPDGFRBPDGFRAPRKCA
SCHEMBL30197820 0.85 PDGFRA (0.85) ABL1BCRPDGFRBPDGFRAPRKCA
SCHEMBL9782 0.85 PDGFRA (1.00) ABL1BCRPDGFRBPDGFRAPRKCA
SCHEMBL9971 0.84 ABL1 (0.57) ABL1BCRPDGFRBPDGFRAPRKCA
SCHEMBL7469833 0.84 ABL1 (0.81) ABL1BCRPDGFRBPDGFRAPRKCA
Methane SCHEMBL5972158 0.84 PDGFRA (0.98) ABL1BCRPDGFRBPDGFRAPRKCA
SCHEMBL4903136 0.84 PDGFRA (0.82) ABL1BCRPDGFRBPDGFRAPRKCA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0564409-B1 Pyrimidin derivatives and process for their preparation NOVARTIS AG (CH) 2000-01-19 EP disclosed
US-5521184-A ANTITUMOR AGENTS; imatinib mesylate CIBA-GEIGY CORPORATION (US) 1996-05-28 US disclosed
EP-0564409-A1 Pyrimidin derivatives and process for their preparation CIBA-GEIGY AG (CH) 1993-10-06 EP disclosed