SCHEMBL14411985

SCHEMBL14411985

C=C(C)c1ccc(NC(=O)c2cccn(-c3ccc(F)cc3)c2=O)cc1F

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MET P08581 15/20 0.61
RIPK3 Q9Y572 5/20 0.61
AXL P30530 7/20 0.58
CYP3A4 P08684 1/20 0.55
CYP2C9 P11712 1/20 0.55
MERTK Q12866 3/20 0.55
TYRO3 Q06418 2/20 0.55
ABL1 P00519 1/20 0.55
RIPK1 Q13546 3/20 0.54
LCK P06239 1/20 0.54
KIT P10721 1/20 0.54
KDR P35968 1/20 0.54
FLT3 P36888 1/20 0.54
RIPK2 O43353 3/20 0.54

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
SCHEMBL13368484 0.86 MET (0.64) METRIPK3AXLCYP3A4CYP2C9
SCHEMBL1161171 0.84 MET (0.66) METRIPK3AXLCYP3A4CYP2C9
SCHEMBL12561530 0.83 MET (0.62) METRIPK3AXLCYP3A4CYP2C9
SCHEMBL2425285 0.81 MET (0.60) METRIPK3AXLCYP3A4CYP2C9
SCHEMBL13212979 0.78 AXL (0.60) METRIPK3AXLCYP3A4CYP2C9
SCHEMBL19377723 0.78 MET (0.56) METRIPK3AXLCYP3A4CYP2C9
SCHEMBL29626156 0.78 MET (0.56) METRIPK3AXLCYP3A4CYP2C9
SCHEMBL18256977 0.78 MET (0.57) METRIPK3AXLCYP3A4CYP2C9
SCHEMBL25648992 0.76 MET (0.56) METRIPK3AXLCYP3A4CYP2C9
SCHEMBL15948862 0.76 MET (0.50) METRIPK3AXLMERTKTYRO3

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-2007103308-A2 HETEROBICYCLIC PYRAZOLE COMPOUNDS AND METHODS OF USE ARRAY BIOPHARMA INC. (US) 2007-09-13 WO disclosed