SCHEMBL3630988

SCHEMBL3630988

Cc1ccc2c(NC3CC3)onc2c1-c1cc2cn(-c3c(F)cccc3F)nc2n(C)c1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 13/20 0.42
PDGFRA P16234 2/20 0.38
MAPKAPK2 P49137 2/20 0.38
MAPK13 O15264 1/20 0.38
RAF1 P04049 1/20 0.38
MAPK12 P53778 1/20 0.38
KCNH2 Q12809 1/20 0.38
MAPK11 Q15759 1/20 0.38
WEE1 P30291 3/20 0.37
FGFR1 P11362 2/20 0.37
ABL1 P00519 1/20 0.36
SRC P12931 2/20 0.34
EGFR P00533 1/20 0.34
PDGFRB P09619 1/20 0.34
STAT5A P42229 1/20 0.34
ACVR1 Q04771 1/20 0.34
PKMYT1 Q99640 1/20 0.34
BRAF P15056 1/20 0.33
LCK P06239 2/20 0.33
KIT P10721 1/20 0.33

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
SCHEMBL3635641 0.88 MAPK14 (0.39) MAPK14MAPKAPK2MAPK11WEE1FGFR1
SCHEMBL3633577 0.86 MAPK14 (0.34) MAPK14PDGFRAMAPKAPK2MAPK13RAF1
SCHEMBL1885642 0.69 MAPK14 (0.82) MAPK14PDGFRAMAPKAPK2MAPK13RAF1
SCHEMBL1892898 0.61 MAPK14 (0.64) MAPK14PDGFRAMAPKAPK2MAPK13RAF1
SCHEMBL1887465 0.61 MAPK14 (0.64) MAPK14PDGFRAMAPKAPK2MAPK13RAF1
SCHEMBL16986316 0.56 WEE1 (0.69) MAPK14PDGFRAWEE1FGFR1ABL1
SCHEMBL5764396 0.54 FGFR1 (1.00) MAPK14PDGFRAWEE1FGFR1ABL1
SCHEMBL5116114 0.52 MAPK14 (0.87) MAPK14MAPK11
SCHEMBL5763591 0.52 SRC (0.77) MAPK14PDGFRAWEE1FGFR1ABL1
SCHEMBL13463624 0.51 ROCK2 (0.51) MAPK14MAPKAPK2KIT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2152706-A1 PYRAZOLO-PYRIDINONE AND PYRAZOLO-PYRAZINONE COMPOUNDS AS P38 MODULATORS, PROCESS FOR THEIR PREPARATION, AND THEIR PHARMACEUTICAL USE Amgen Inc. (US) 2010-02-17 EP claimed
WO-2008136948-A1 PYRAZOLO-PYRIDINONE AND PYRAZOLO-PYRAZINONE COMPOUNDS AS P38 MODULATORS, PROCESS FOR THEIR PREPARATION, AND THEIR PHARMACEUTICAL USE AMGEN INC. (US) 2008-11-13 WO claimed