SCHEMBL15864243

SCHEMBL15864243

Clc1nc(Nc2ccccn2)ncc1I

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNA2 P20248 3/20 0.51
CDK2 P24941 3/20 0.51
CCND3 P30281 3/20 0.51
CCNK O75909 1/20 0.51
CDK9 P50750 1/20 0.51
CDK6 Q00534 1/20 0.51
CTSC P53634 2/20 0.45
KDR P35968 4/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
MAPK10 P53779 1/20 0.44
GFER P55789 1/20 0.44
CDK4 P11802 3/20 0.41
CCND1 P24385 3/20 0.41
CCNA1 P78396 2/20 0.41
CCND2 P30279 2/20 0.41
FLT3 P36888 1/20 0.40
TYRO3 Q06418 1/20 0.40
MERTK Q12866 1/20 0.40
GAS6 Q14393 1/20 0.40

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
SCHEMBL4065994 0.81 CCNA2 (0.45) CCNA2CDK2CCND3CCNKCDK9
SCHEMBL30656321 0.75 CCNA2 (0.46) CCNA2CDK2CCND3CCNKCDK9
SCHEMBL15864563 0.73 MEN1 (0.50) CCNA2CDK2CCND3CCNKCDK9
SCHEMBL10639645 0.73 NFKB1 (0.55) CCNA2CDK2CCND3CCNKCDK9
SCHEMBL1133352 0.72 KMT2A (0.48) CCNA2CDK2CCND3CCNKCDK9
SCHEMBL1883319 0.72 KMT2A (0.57) CCNA2CDK2CCND3CCNKCDK9
SCHEMBL29544002 0.71 MEN1 (0.67) KDRMEN1KMT2AMAPK10GFER
SCHEMBL3951276 0.71 MEN1 (0.67) KDRMEN1KMT2AMAPK10GFER
SCHEMBL6323476 0.71 MEN1 (0.47) CCNA2CDK2CCND3CCNKCDK9
SCHEMBL6402766 0.71 KMT2A (0.47) CCNA2CDK2CCND3CCNKCDK9

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
WO-2014106800-A2 SUBSTITUTED 2-AMINO PYRIMIDINE DERIVATIVES AS KINASE INHIBITORS AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2014-07-10 WO disclosed