SCHEMBL13635799

SCHEMBL13635799

CC(=O)N(C)c1ccc2[nH]nc(-c3ccc4ccccc4c3)c2c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPKAPK2 P49137 3/20 0.45
CDK4 P11802 1/20 0.45
CCNA2 P20248 1/20 0.45
CCND1 P24385 1/20 0.45
CDK2 P24941 1/20 0.45
CCND3 P30281 1/20 0.45
KDR P35968 1/20 0.45
ITK Q08881 2/20 0.42
LRRK2 Q5S007 1/20 0.41
MAP2K4 P45985 6/20 0.41
MAPK1 P28482 4/20 0.41
MAPKAPK3 Q16644 4/20 0.41
MAPK6 Q16659 4/20 0.41
MAPKAPK5 Q8IW41 2/20 0.40
MAPK8 P45983 4/20 0.40
TTK P33981 3/20 0.40
CA12 O43570 1/20 0.40
ALPL P05186 1/20 0.39
MAPK9 P45984 1/20 0.39
MAPK10 P53779 1/20 0.39

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
SCHEMBL2861016 0.77 ITK (0.68) MAPKAPK2ITKMAPK8TTK
SCHEMBL2855850 0.76 MAP2K4 (0.59) MAPKAPK2CDK4CCNA2CCND1CDK2
SCHEMBL1137614 0.76 PDK2 (0.47) MAPK1
SCHEMBL5374570 0.75 MAP2K4 (0.59) MAPKAPK2CDK4CCNA2CCND1CDK2
SCHEMBL2861069 0.75 ALPL (0.54) MAPKAPK2CDK4CCNA2CCND1CDK2
SCHEMBL13927625 0.73 IDO1 (0.63) MAPKAPK2CDK4CCNA2CCND1CDK2
SCHEMBL2867128 0.72 MAPK1 (0.58) MAPK1MAPK8TTKCSNK1D
SCHEMBL2864712 0.72 ITK (0.56) MAPKAPK2ITKTTK
SCHEMBL13742858 0.72 CYP1A2 (0.51) MAPKAPK2CDK4CCNA2CCND1CDK2
SCHEMBL5375303 0.70 MAPT (0.73) MAPKAPK2CDK4CCNA2CCND1CDK2

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-1380576-B1 1H-INDAZOLE COMPOUNDS INHIBITING JNK EISAI R&D MAN CO LTD (JP) 2009-11-25 EP disclosed