SCHEMBL1406008

SCHEMBL1406008

Cc1ccc(C(=O)Nc2cncnc2)cc1-c1ccc2c(NC(C)C)nncc2c1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 15/20 0.52
KIT P10721 10/20 0.52
KDR P35968 10/20 0.52
LCK P06239 7/20 0.52
MAPK9 P45984 6/20 0.52
MAPK10 P53779 2/20 0.47
LYN P07948 1/20 0.47
ABL1 P00519 4/20 0.45
DDR2 Q16832 1/20 0.43
CYP3A4 P08684 1/20 0.43
CSF1R P07333 1/20 0.39
JAK3 P52333 1/20 0.39
TEK Q02763 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
SCHEMBL2952103 0.86 MAPK14 (0.55) MAPK14KITKDRLCKMAPK9
SCHEMBL2957471 0.86 MAPK14 (0.57) MAPK14KITKDRLCKMAPK9
SCHEMBL2950842 0.85 MAPK14 (0.53) MAPK14KITKDRLCKMAPK9
SCHEMBL2946751 0.85 MAPK14 (0.55) MAPK14KITKDRLCKMAPK9
SCHEMBL2954302 0.84 MAPK14 (0.54) MAPK14KITKDRLCKMAPK9
SCHEMBL2953486 0.83 MAPK14 (0.53) MAPK14KITKDRLCKMAPK9
SCHEMBL1406122 0.83 MAPK14 (0.51) MAPK14KITKDRLCKMAPK9
SCHEMBL2955016 0.82 MAPK14 (0.73) MAPK14KITKDRLCKMAPK9
SCHEMBL1406043 0.82 ABL1 (0.60) MAPK14KITKDRLCKMAPK9
SCHEMBL397085 0.82 MAPK14 (0.49) MAPK14KITKDRLCKMAPK9

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-2077998-B1 PHTHALAZINE, AZA- AND DIAZA-PHTHALAZINE COMPOUNDS AND METHODS OF USE AMGEN INC (US) 2011-03-09 EP disclosed