SCHEMBL7474975

SCHEMBL7474975

CC(C)c1ccc(Nc2nccc(-c3cccnc3)n2)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 15/20 0.71
PRKCA P17252 10/20 0.71
PRKCD Q05655 7/20 0.71
EGFR P00533 3/20 0.71
BCR P11274 13/20 0.62
CCNK O75909 1/20 0.60
CDK4 P11802 1/20 0.60
CCNC P24863 1/20 0.60
CDK2 P24941 1/20 0.60
CDK8 P49336 1/20 0.60
GSK3B P49841 1/20 0.60
CDK9 P50750 1/20 0.60
CDK19 Q9BWU1 1/20 0.60
SRC P12931 7/20 0.58
PRKACA P17612 1/20 0.58
PRKACG P22612 1/20 0.58
PRKACB P22694 1/20 0.58
PRKD3 O94806 2/20 0.58
PRKCG P05129 2/20 0.58
PRKCB P05771 2/20 0.58

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
SCHEMBL7464305 0.90 ABL1 (0.67) ABL1PRKCAPRKCDEGFRBCR
SCHEMBL7464340 0.90 ABL1 (0.67) ABL1PRKCAPRKCDEGFRBCR
SCHEMBL7472323 0.86 ABL1 (0.62) ABL1PRKCAPRKCDEGFRBCR
SCHEMBL3868291 0.85 ABL1 (0.76) ABL1PRKCAPRKCDEGFRBCR
SCHEMBL6262145 0.83 ABL1 (1.00) ABL1PRKCAPRKCDEGFRBCR
SCHEMBL23259373 0.83 ABL1 (0.72) ABL1PRKCAEGFRBCRPDGFRB
SCHEMBL21004289 0.83 ABL1 (0.62) ABL1PRKCAPRKCDEGFRBCR
SCHEMBL7464205 0.82 ABL1 (0.76) ABL1PRKCAPRKCDEGFRBCR
SCHEMBL7461475 0.82 ABL1 (0.76) ABL1PRKCAPRKCDEGFRBCR
SCHEMBL7476133 0.82 ABL1 (0.76) ABL1PRKCAPRKCDEGFRBCR

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
EP-0233461-B2 4,5,6-Substituted-2-pyrimidinamines AMERICAN CYANAMID CO (US) 2002-05-29 EP disclosed