SCHEMBL8282151

SCHEMBL8282151

COc1ccccc1C(=O)Cl.COc1ccccc1C(=O)Nc1ccc(C)c(Nc2nccc(-c3cccnc3)n2)c1

nearest known ligand 0.92

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 12/20 0.92
PDGFRA P16234 12/20 0.92
BCR P11274 9/20 0.92
PDGFRB P09619 7/20 0.92
PRKCA P17252 4/20 0.92
EGFR P00533 3/20 0.73
KIT P10721 4/20 0.63
JAK3 P52333 1/20 0.61
BTK Q06187 1/20 0.61
ITK Q08881 1/20 0.61

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
SCHEMBL9666 0.96 PDGFRA (1.00) ABL1PDGFRABCRPDGFRBPRKCA
SCHEMBL4896195 0.87 ABL1 (0.84) ABL1PDGFRABCRPDGFRBPRKCA
SCHEMBL4892567 0.85 ABL1 (0.84) ABL1PDGFRABCRPDGFRBPRKCA
SCHEMBL4903174 0.85 ABL1 (0.79) ABL1PDGFRABCRPDGFRBPRKCA
SCHEMBL27841120 0.85 ABL1 (0.79) ABL1PDGFRABCRPDGFRBPRKCA
SCHEMBL9338 0.84 ABL1 (1.00) ABL1PDGFRABCRPDGFRBPRKCA
SCHEMBL3219529 0.84 ABL1 (0.77) ABL1PDGFRABCRPDGFRBPRKCA
SCHEMBL4900131 0.83 PDGFRA (0.77) ABL1PDGFRABCRPDGFRBPRKCA
SCHEMBL28381450 0.83 ABL1 (0.74) ABL1PDGFRABCRPDGFRBPRKCA
SCHEMBL4901273 0.83 ABL1 (0.76) ABL1PDGFRABCRPDGFRBPRKCA

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-0564409-B1 Pyrimidin derivatives and process for their preparation NOVARTIS AG (CH) 2000-01-19 EP disclosed
EP-0564409-A1 Pyrimidin derivatives and process for their preparation CIBA-GEIGY AG (CH) 1993-10-06 EP disclosed