SCHEMBL18040366

SCHEMBL18040366

O=C(Nc1ccc(Nc2ncnc3cc4c(cc23)OCCOCCOCCO4)c(F)c1)Oc1c[nH]cc(-c2ccc(F)cc2)c1=O

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MET P08581 3/20 0.52
KDR P35968 3/20 0.52
EGFR P00533 17/20 0.46
PDGFRB P09619 1/20 0.39
GAK O14976 1/20 0.38
RIPK2 O43353 1/20 0.38
BUB1 O43683 1/20 0.38
STK10 O94804 1/20 0.38
CARS1 P49589 1/20 0.38
MAP3K1 Q13233 1/20 0.38
PIP4K2C Q8TBX8 1/20 0.38
SLK Q9H2G2 1/20 0.38

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
SCHEMBL18040363 0.90 MET (0.49) METKDR
SCHEMBL371039 0.88 MET (0.51) METKDREGFRGAKRIPK2
SCHEMBL18040365 0.87 MET (0.64) METKDRPDGFRB
SCHEMBL18040358 0.86 MET (0.48) METKDREGFRPDGFRB
SCHEMBL18040360 0.83 MET (0.54) METKDREGFRPDGFRBRIPK2
SCHEMBL18040371 0.82 MET (0.47) METKDR
SCHEMBL10133775 0.77 MET (0.50) METKDR
SCHEMBL368546 0.76 MET (0.65) METKDRPDGFRB
SCHEMBL10133801 0.73 MET (0.46) METKDREGFR
SCHEMBL10134550 0.72 MET (0.67) METKDR

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-2593462-B1 NOVEL FUSED HETEROCYCLIC DERIVATIVES USEFUL AS C-MET TYROSINE KINASE INHIBITORS BETTA PHARMACEUTICALS CO LTD (CN) 2016-09-07 EP claimed