SCHEMBL2467463

SCHEMBL2467463

COCc1nccc(Oc2ccc3c(C(=O)Nc4ccc(CN5CCN(C)CC5)c(C(F)(F)F)c4)cccc3c2)n1

nearest known ligand 0.63

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDR P35968 5/20 0.63
CDK1 P06493 1/20 0.59
CDK2 P24941 1/20 0.59
CDK8 P49336 1/20 0.59
SRC P12931 6/20 0.58
ABL1 P00519 5/20 0.58
FLT1 P17948 2/20 0.55
FLT4 P35916 2/20 0.55
KIT P10721 2/20 0.52
RET P07949 7/20 0.51
PDGFRB P09619 1/20 0.50

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
SCHEMBL2469544 0.93 KDR (0.65) KDRCDK1CDK2CDK8SRC
SCHEMBL2437488 0.90 KDR (0.78) KDRCDK1CDK2CDK8SRC
SCHEMBL2465036 0.88 KDR (0.56) KDRCDK1CDK2CDK8SRC
SCHEMBL2473024 0.85 KDR (0.76) KDRFLT1FLT4KITRET
SCHEMBL2471571 0.85 KDR (0.65) KDRFLT1FLT4KITRET
SCHEMBL2436227 0.84 KDR (0.70) KDRCDK1CDK2CDK8SRC
SCHEMBL10301389 0.84 SRC (0.60) KDRCDK1CDK2CDK8SRC
SCHEMBL2435727 0.84 KDR (0.56) KDRCDK1CDK2CDK8SRC
SCHEMBL2465925 0.84 KDR (0.65) KDRCDK1CDK2CDK8SRC
SCHEMBL30151207 0.83 KDR (0.57) KDRCDK1CDK2CDK8SRC

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-2371822-A1 Heterobicyclic carboxamides as inhibitors for kinases Novartis AG (CH) 2011-10-05 EP claimed