SCHEMBL4813334

SCHEMBL4813334

CN(C(=O)CC(=O)Nc1ccc(Oc2ccnc3[nH]ccc23)c(F)c1)c1ccc(F)cc1

nearest known ligand 0.78

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MET P08581 20/20 0.78
KIT P10721 3/20 0.56
FLT3 P36888 3/20 0.56
KDR P35968 2/20 0.56
EGFR P00533 1/20 0.56
PDGFRB P09619 1/20 0.56
LCK P06239 1/20 0.55
RIPK1 Q13546 1/20 0.55
RIPK3 Q9Y572 1/20 0.55

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
SCHEMBL4818385 0.88 MET (1.00) METKITFLT3KDREGFR
SCHEMBL4772466 0.83 MET (0.80) METFLT3KDR
SCHEMBL4820020 0.83 MET (0.86) METFLT3KDR
SCHEMBL4068304 0.83 MET (0.83) METFLT3KDR
SCHEMBL4820675 0.82 MET (0.84) METKITFLT3KDREGFR
SCHEMBL4822627 0.82 MET (0.84) METKITFLT3KDRLCK
SCHEMBL4821200 0.82 MET (0.84) METKITFLT3KDRLCK
SCHEMBL4819198 0.82 MET (0.80) METKITFLT3KDREGFR
SCHEMBL4815436 0.81 MET (0.79) METKITFLT3KDREGFR
SCHEMBL4820088 0.81 MET (0.79) METKITFLT3KDREGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7439246-B2 Fused heterocyclic kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2008-10-21 US claimed
US-7439246-B2 Fused heterocyclic kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2008-10-21 US disclosed
US-7173031-B2 Pyrrolotriazine kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2007-02-06 US disclosed