SCHEMBL9958743

SCHEMBL9958743

O=C(Cc1ccc(F)cc1)NC(=O)Nc1ccc(Oc2ccnc(NC(=O)ON3CCC(N4CCC4)CC3)c2)cc1F

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 11/20 0.51
MET P08581 6/20 0.51
MAPK14 Q16539 5/20 0.51
PDGFRB P09619 2/20 0.51
FLT3 P36888 2/20 0.51
EPHB6 O15197 1/20 0.51
RIPK2 O43353 1/20 0.51
ABL1 P00519 1/20 0.51
NTRK1 P04629 1/20 0.51
LCK P06239 1/20 0.51
LYN P07948 1/20 0.51
RET P07949 1/20 0.51
HCK P08631 1/20 0.51
BCR P11274 1/20 0.51
EPHA2 P29317 1/20 0.51
EPHB2 P29323 1/20 0.51
ABL2 P42684 1/20 0.51
FRK P42685 1/20 0.51
LIMK1 P53667 1/20 0.51
EPHB3 P54753 1/20 0.51

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
SCHEMBL13861404 0.90 KDR (0.63) KDRMETMAPK14PDGFRBFLT3
SCHEMBL14366410 0.88 KDR (0.63) KDRMETMAPK14PDGFRBFLT3
SCHEMBL9960110 0.86 MET (0.60) KDRMETPDGFRBFLT3NTRK1
SCHEMBL9958584 0.84 KDR (0.46) KDRMETMAPK14PDGFRBFLT3
SCHEMBL13861482 0.84 KDR (0.55) KDRMETMAPK14PDGFRBFLT3
SCHEMBL13861402 0.83 KDR (0.60) KDRMETMAPK14PDGFRBFLT3
SCHEMBL13861050 0.82 KDR (0.55) KDRMETMAPK14PDGFRBFLT3
SCHEMBL14366393 0.82 KDR (0.60) KDRMETMAPK14PDGFRBFLT3
SCHEMBL14366274 0.82 MET (0.52) KDRMETMAPK14PDGFRBFLT3
SCHEMBL4333954 0.80 MET (0.59) KDRMETMAPK14PDGFRBFLT3

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-1719762-B1 NOVEL PYRIDINE DERIVATIVE AND PYRIMIDINE DERIVATIVE (1) EISAI R&D MAN CO LTD (JP) 2012-06-27 EP claimed