SCHEMBL7467183

SCHEMBL7467183

CCc1ccc(Nc2nccc(-c3c[nH]c4ccccc34)n2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 3/20 0.60
MKNK1 Q9BUB5 2/20 0.60
MKNK2 Q9HBH9 2/20 0.60
RET P07949 8/20 0.60
CCNB2 O95067 4/20 0.59
CDK1 P06493 4/20 0.59
CCNB1 P14635 4/20 0.59
CCNB3 Q8WWL7 4/20 0.59
EIF2AK2 P19525 1/20 0.58
EGFR P00533 2/20 0.54
ABL1 P00519 1/20 0.54
BCR P11274 1/20 0.54
SRC P12931 1/20 0.54
PRKCA P17252 1/20 0.54
PRKACA P17612 1/20 0.54
PRKACG P22612 1/20 0.54
PRKACB P22694 1/20 0.54
PRKCD Q05655 1/20 0.54
BRD4 O60885 1/20 0.53
MAPK8 P45983 1/20 0.53

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
SCHEMBL144954 0.87 CCNB2 (0.76) FLT3MKNK1MKNK2RETCCNB2
SCHEMBL31588329 0.87 CCNB2 (0.76) FLT3MKNK1MKNK2RETCCNB2
SCHEMBL4510383 0.85 FLT3 (0.64) FLT3MKNK1MKNK2RETCCNB2
SCHEMBL4517500 0.84 FLT3 (0.60) FLT3MKNK1MKNK2RETCCNB2
SCHEMBL29001476 0.84 FLT3 (0.60) FLT3MKNK1MKNK2RETCCNB2
SCHEMBL30171056 0.84 FLT3 (0.60) FLT3MKNK1MKNK2RETCCNB2
SCHEMBL140969 0.81 CCNB2 (0.64) FLT3MKNK1MKNK2RETCCNB2
SCHEMBL29001472 0.81 FLT3 (0.61) FLT3MKNK1MKNK2RETCCNB2
SCHEMBL7474541 0.80 RET (0.50) RETCCNB2CDK1CCNB1CCNB3
SCHEMBL23624996 0.80 FLT3 (0.58) FLT3MKNK1MKNK2RETCCNB2

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