SCHEMBL4370091

SCHEMBL4370091

COc1ccc(C(=O)O)cc1Nc1nccc(-c2cccnc2)n1

nearest known ligand 0.80

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 16/20 0.80
BCR P11274 16/20 0.80
PRKCA P17252 3/20 0.73
PIK3CG P48736 2/20 0.66
CAMKK2 Q96RR4 2/20 0.66
MAPK8 P45983 1/20 0.66
PRKD3 O94806 1/20 0.62
PRKCG P05129 1/20 0.62
PRKCB P05771 1/20 0.62
LCK P06239 1/20 0.62
PRKCH P24723 1/20 0.62
PRKCI P41743 1/20 0.62
ZAP70 P43403 1/20 0.62
PRKCE Q02156 1/20 0.62
PRKCQ Q04759 1/20 0.62
PRKCZ Q05513 1/20 0.62
PRKCD Q05655 1/20 0.62
PRKD1 Q15139 1/20 0.62
SRC P12931 1/20 0.59

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
SCHEMBL533540 0.86 ABL1 (0.71) ABL1BCRPRKCACAMKK2
SCHEMBL29707254 0.86 ABL1 (0.71) ABL1BCRPRKCACAMKK2
SCHEMBL23798722 0.84 ABL1 (0.66) ABL1BCRPRKCAPRKD3PRKCG
SCHEMBL3869178 0.84 ABL1 (0.74) ABL1BCRPRKCAPIK3CGCAMKK2
SCHEMBL4382247 0.84 PDGFRB (0.71) ABL1BCRPRKCAPIK3CGCAMKK2
SCHEMBL4377508 0.83 ABL1 (0.73) ABL1BCRPRKCAPIK3CGCAMKK2
SCHEMBL16795493 0.82 ABL1 (0.64) ABL1BCRPRKCAPRKD3PRKCG
SCHEMBL7461093 0.82 PRKCA (0.69) ABL1BCRPRKCAPIK3CGCAMKK2
SCHEMBL4894119 0.82 ABL1 (0.65) ABL1BCRPRKCAPRKD3PRKCG
SCHEMBL3864409 0.80 ABL1 (0.66) ABL1BCRPRKCAPIK3CGPRKD3

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
WO-2009109991-A2 NOVEL HYDRAZIDE CONTAINING TYROSINE KINASE INHIBITORS SUN PHARMA ADVANCED RESEARCH COMPANY LTD., (IN) 2009-09-11 WO claimed
WO-2009109991-A2 NOVEL HYDRAZIDE CONTAINING TYROSINE KINASE INHIBITORS SUN PHARMA ADVANCED RESEARCH COMPANY LTD., (IN) 2009-09-11 WO disclosed