SCHEMBL6676871

SCHEMBL6676871

[CH2]c1ccc(N(C)c2ccnc(Nc3cccc(CS(C)(=O)=O)c3)n2)cc1

nearest known ligand 0.75

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KDR P35968 19/20 0.75

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
SCHEMBL13980535 0.91 KDR (0.76) KDR
SCHEMBL13980541 0.90 KDR (0.78) KDR
SCHEMBL4814968 0.87 KDR (0.77) KDR
SCHEMBL4813427 0.85 KDR (1.00) KDR
SCHEMBL4815149 0.85 KDR (1.00) KDR
SCHEMBL4810035 0.85 KDR (0.80) KDR
SCHEMBL4809489 0.85 KDR (0.80) KDR
SCHEMBL4804557 0.85 KDR (0.85) KDR
SCHEMBL4806044 0.85 KDR (1.00) KDR
SCHEMBL4814948 0.84 KDR (0.84) KDR

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1472233-A1 PYRIMIDINE COMPOUNDS SmithKline Beecham Corporation (US) 2004-11-03 EP claimed
WO-2003066601-A1 PYRIMIDINE COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2003-08-14 WO claimed
EP-1472233-A1 PYRIMIDINE COMPOUNDS SmithKline Beecham Corporation (US) 2004-11-03 EP disclosed
WO-2003066601-A1 PYRIMIDINE COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2003-08-14 WO disclosed