SCHEMBL7469712

SCHEMBL7469712

Cc1ccc(Nc2nccc(-c3ccccn3)n2)c(C)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 13/20 0.49
SRC P12931 1/20 0.49
RET P07949 2/20 0.47
ABL1 P00519 1/20 0.47
BCR P11274 1/20 0.47
PRKCA P17252 1/20 0.47
PIK3CG P48736 1/20 0.47
CCNB2 O95067 1/20 0.46
CDK1 P06493 1/20 0.46
CCNB1 P14635 1/20 0.46
CCNB3 Q8WWL7 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
GSK3B P49841 1/20 0.46
DYRK1A Q13627 1/20 0.46
TP53 P04637 1/20 0.46
GAA P10253 1/20 0.46
MAPT P10636 1/20 0.46
HTT P42858 1/20 0.46
KMT2A Q03164 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46

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
SCHEMBL7477243 0.89 SYK (0.62) SYKSRCRETABL1BCR
SCHEMBL7466250 0.82 CAMKK2 (0.50) SYKSRCABL1BCRPRKCA
SCHEMBL17666287 0.81 RAPGEF4 (0.55) SMN1; SMN2MAPTHTTKMT2ANPSR1
SCHEMBL2823600 0.81 KCNN1 (0.62) SYKABL1BCRPRKCAGSK3B
SCHEMBL7471678 0.80 ABL1 (0.64) SYKSRCRETABL1BCR
SCHEMBL7472267 0.80 PIK3CG (0.57) SYKSRCABL1BCRPRKCA
SCHEMBL4893292 0.79 ABL1 (0.65) SYKSRCRETABL1BCR
SCHEMBL7464938 0.79 KDR (0.64) SYKSRCABL1BCRPRKCA
SCHEMBL22628286 0.78 ABL1 (0.70) SRCABL1BCRPRKCA
SCHEMBL7461176 0.77 SYK (0.62) SYKABL1BCRPRKCA

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