SCHEMBL396254

SCHEMBL396254

Cc1cccc(C(=O)Nc2cccc(Oc3ccc4c(c3)NC(=O)C4=Cc3[nH]c(C)c(C(=O)N(C)CCN(C)C)c3C)c2)c1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 11/20 0.48
AURKB Q96GD4 9/20 0.48
PDGFRB P09619 3/20 0.48
MET P08581 2/20 0.48
AURKA O14965 1/20 0.48
AURKC Q9UQB9 1/20 0.48
KDR P35968 8/20 0.48
FLT4 P35916 4/20 0.48
KIT P10721 2/20 0.48
NTRK2 Q16620 1/20 0.46
PRKAA1 Q13131 6/20 0.46
PRKAA2 P54646 5/20 0.46
FGFR1 P11362 1/20 0.46

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
SCHEMBL10091941 1.00 FLT3 (0.48) FLT3AURKBPDGFRBMETAURKA
SCHEMBL397475 0.91 NTRK2 (0.53) FLT3AURKBPDGFRBMETAURKA
SCHEMBL395647 0.88 FLT3 (0.62) FLT3AURKBPDGFRBMETAURKA
SCHEMBL395648 0.88 FLT3 (0.62) FLT3AURKBPDGFRBMETAURKA
SCHEMBL394066 0.85 AKT2 (0.46) FLT3AURKBPDGFRBKDRFLT4
SCHEMBL10091936 0.85 AKT2 (0.46) FLT3AURKBPDGFRBKDRFLT4
SCHEMBL396225 0.84 NTRK2 (0.53) FLT3AURKBPDGFRBMETAURKA
SCHEMBL396226 0.84 NTRK2 (0.53) FLT3AURKBPDGFRBMETAURKA
SCHEMBL393105 0.82 FLT3 (0.59) FLT3AURKBPDGFRBMETAURKA
SCHEMBL393104 0.82 FLT3 (0.59) FLT3AURKBPDGFRBMETAURKA

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
US-8101608-B2 3-(4-Methyl-imidazol-1-yl)-N-{3-[2-oxo-3-(1H-pyrrol-2-ylmethylene)-2,3-dihydro-1H-indol-6-ylamino]-phenyl}-5-trifluoromethyl-benzamide; including benign and malignant proliferative disorders as well as diseases resulting from inappropriate activation of the immune and nervous systems IRM LLC, a Delware Limited Corporation (BM) 2012-01-24 US claimed
US-8101608-B2 3-(4-Methyl-imidazol-1-yl)-N-{3-[2-oxo-3-(1H-pyrrol-2-ylmethylene)-2,3-dihydro-1H-indol-6-ylamino]-phenyl}-5-trifluoromethyl-benzamide; including benign and malignant proliferative disorders as well as diseases resulting from inappropriate activation of the immune and nervous systems IRM LLC, a Delware Limited Corporation (BM) 2012-01-24 US disclosed