SCHEMBL5323716

SCHEMBL5323716

CNC(=O)c1c(C)[nH]c2ccc(Oc3ncnc(N)c3C=NOC)c(F)c12

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KDR P35968 20/20 0.58
RET P07949 3/20 0.50
MET P08581 1/20 0.47

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
SCHEMBL5321249 0.82 KDR (0.61) KDRRET
SCHEMBL5321155 0.74 KDR (0.65) KDRRET
SCHEMBL2455241 0.73 KDR (1.00) KDRRET
SCHEMBL12303457 0.73 KDR (1.00) KDRRET
SCHEMBL2451711 0.73 KDR (0.72) KDRRET
SCHEMBL12303579 0.73 KDR (0.72) KDRRET
SCHEMBL12303524 0.73 KDR (0.57) KDRRETMET
SCHEMBL2453105 0.73 KDR (0.57) KDRRETMET
SCHEMBL5323283 0.72 KDR (0.60) KDRRET
SCHEMBL5325591 0.72 KDR (0.60) KDRRET

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
WO-2007109783-A2 SUBSTITUTED PYRIMIDINE KINASE INHIBITORS JANSSEN PHARMACEUTICA, N.V. (BE) 2007-09-27 WO disclosed