SCHEMBL30359587

SCHEMBL30359587

Cc1ccc(I)cc1Nc1nccc(-c2cccnc2)n1

nearest known ligand 0.75

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 15/20 0.75
BCR P11274 14/20 0.75
PRKCA P17252 3/20 0.73
PDGFRB P09619 6/20 0.68
PDGFRA P16234 6/20 0.68
EGFR P00533 4/20 0.63
JAK3 P52333 1/20 0.63
BTK Q06187 1/20 0.63
ITK Q08881 1/20 0.63
KIT P10721 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
SCHEMBL29005835 1.00 ABL1 (0.75) ABL1BCRPRKCAPDGFRBPDGFRA
SCHEMBL12320924 0.88 ABL1 (0.78) ABL1BCRPRKCAPDGFRBPDGFRA
SCHEMBL18814452 0.86 PRKCA (0.81) ABL1BCRPRKCAPDGFRBPDGFRA
SCHEMBL23259373 0.86 ABL1 (0.72) ABL1BCRPRKCAPDGFRBPDGFRA
SCHEMBL29555505 0.86 ABL1 (1.00) ABL1BCRPRKCAPDGFRBPDGFRA
SCHEMBL2392 0.86 ABL1 (1.00) ABL1BCRPRKCAPDGFRBPDGFRA
SCHEMBL18560357 0.86 ABL1 (0.75) ABL1BCRPRKCAPDGFRBPDGFRA
SCHEMBL3210634 0.86 ABL1 (0.75) ABL1BCRPRKCAPDGFRBPDGFRA
SCHEMBL29366999 0.86 ABL1 (1.00) ABL1BCRPRKCAPDGFRBPDGFRA
SCHEMBL805400 0.85 ABL1 (0.73) ABL1BCRPRKCAPDGFRBPDGFRA

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
CN-112125882-B Method for synthesizing imatinib free base 山东汇海医药化工有限公司 2023-04-11 CN disclosed