SCHEMBL29693450

SCHEMBL29693450

CCN(CC)CCCOc1cc2c(Oc3ccc(NC(=O)C4(C(=O)Nc5ccc(F)cc5)CC4)cc3F)ccnc2cc1OC

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 16/20 0.79
KDR P35968 8/20 0.79
AXL P30530 7/20 0.79
RET P07949 3/20 0.78
KIT P10721 3/20 0.78
FLT3 P36888 3/20 0.78
HDAC2 Q92769 2/20 0.78
HDAC8 Q9BY41 2/20 0.78
HDAC6 Q9UBN7 2/20 0.78
PDGFRB P09619 2/20 0.78
HDAC10 Q969S8 1/20 0.76
HDAC11 Q96DB2 1/20 0.76
MERTK Q12866 5/20 0.73
FLT1 P17948 3/20 0.73
AURKB Q96GD4 3/20 0.73
AURKA O14965 2/20 0.73
RIPK2 O43353 2/20 0.73
ABL1 P00519 2/20 0.73
EGFR P00533 2/20 0.73
ERBB2 P04626 2/20 0.73

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
SCHEMBL372083 1.00 MET (0.79) METKDRAXLRETKIT
SCHEMBL371775 1.00 MET (0.79) METKDRAXLRETKIT
SCHEMBL29693434 1.00 MET (0.79) METKDRAXLRETKIT
SCHEMBL372310 0.97 MET (0.75) METKDRAXLRETKIT
SCHEMBL29693447 0.97 MET (0.75) METKDRAXLRETKIT
SCHEMBL371806 0.96 MET (0.81) METKDRAXLRETKIT
SCHEMBL371980 0.96 MET (0.81) METKDRAXLRETKIT
SCHEMBL29693432 0.96 MET (0.81) METKDRAXLRETKIT
SCHEMBL29693437 0.96 MET (0.81) METKDRAXLRETKIT
SCHEMBL24444600 0.95 MET (0.71) METKDRAXLRETKIT

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-3329918-B1 C-MET MODULATORS AND METHODS OF USE EXELIXIS INC (US) 2022-05-25 EP claimed
EP-3329918-B1 C-MET MODULATORS AND METHODS OF USE EXELIXIS INC (US) 2022-05-25 EP disclosed