SCHEMBL3633577

SCHEMBL3633577

Cc1ccc2c(NC3CC3)onc2c1-c1nc2cn(-c3c(F)cccc3F)nc2n(C)c1=O

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 9/20 0.34
MAPK13 O15264 1/20 0.32
RAF1 P04049 1/20 0.32
PDGFRA P16234 1/20 0.32
MAPKAPK2 P49137 1/20 0.32
MAPK12 P53778 1/20 0.32
KCNH2 Q12809 1/20 0.32
MAPK11 Q15759 1/20 0.32

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
SCHEMBL3630988 0.86 MAPK14 (0.42) MAPK14MAPK13RAF1PDGFRAMAPKAPK2
SCHEMBL3635641 0.73 MAPK14 (0.39) MAPK14MAPKAPK2MAPK11
SCHEMBL1889876 0.69 MAPK14 (0.60) MAPK14MAPK13RAF1PDGFRAMAPKAPK2
SCHEMBL1885642 0.61 MAPK14 (0.82) MAPK14MAPK13RAF1PDGFRAMAPKAPK2
SCHEMBL1882591 0.60 MAPK14 (0.48) MAPK14MAPKAPK2
SCHEMBL27888227 0.51 OPRL1 (0.42) KCNH2
SCHEMBL31532127 0.51 CYP1A2 (0.47) MAPK14
SCHEMBL11055943 0.50 HCAR1 (0.41)
SCHEMBL9919079 0.50 PARG (0.41)
SCHEMBL30885804 0.49 GAA (0.46) MAPK14

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