SCHEMBL4822232

SCHEMBL4822232

O=C(CC(=O)NC1CC1)Nc1ccc(Oc2ccnc3[nH]ccc23)c(F)c1

nearest known ligand 0.77

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MET P08581 19/20 0.77
FLT3 P36888 3/20 0.55
KDR P35968 2/20 0.54
LCK P06239 1/20 0.54
KIT P10721 1/20 0.54
RIPK1 Q13546 1/20 0.54
RIPK3 Q9Y572 1/20 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
SCHEMBL4813820 0.96 MET (0.75) METFLT3KDRLCKKIT
SCHEMBL4821579 0.95 MET (0.73) METFLT3KDRLCKKIT
SCHEMBL4821286 0.95 MET (0.73) METFLT3KDRLCKKIT
SCHEMBL4815536 0.94 MET (0.71) METFLT3KDRLCKKIT
SCHEMBL4820020 0.88 MET (0.86) METFLT3KDR
SCHEMBL4822721 0.88 MET (0.70) METFLT3KDRLCKKIT
SCHEMBL4814917 0.88 MET (0.70) METFLT3KDRLCKKIT
SCHEMBL4818385 0.87 MET (1.00) METFLT3KDRLCKKIT
SCHEMBL4814798 0.86 MET (0.86) METFLT3KDR
SCHEMBL4822304 0.86 MET (0.86) 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 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