SCHEMBL3471677

SCHEMBL3471677

Cc1cc(C(=O)Nc2cccc(C#Cc3cc(C(=O)N=S(C)(=O)c4c[c]ccc4)cnc3N)c2)n(C)n1

nearest known ligand 0.56

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KDR P35968 20/20 0.56
PDGFRB P09619 15/20 0.55

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
SCHEMBL834895 0.92 KDR (0.61) KDRPDGFRB
SCHEMBL848782 0.92 KDR (0.61) KDRPDGFRB
SCHEMBL837369 0.89 KDR (0.58) KDRPDGFRB
SCHEMBL12751013 0.89 KDR (0.58) KDRPDGFRB
SCHEMBL835523 0.88 KDR (0.56) KDRPDGFRB
SCHEMBL12751011 0.88 KDR (0.56) KDRPDGFRB
SCHEMBL15810034 0.86 KDR (0.55) KDRPDGFRB
SCHEMBL835335 0.86 KDR (0.55) KDRPDGFRB
SCHEMBL835091 0.86 KDR (0.55) KDRPDGFRB
SCHEMBL12751064 0.85 KDR (0.55) KDRPDGFRB

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
EP-2099757-B1 SULFOXIMINES AS KINASE INHIBITORS ALLERGAN INC (US) 2014-06-25 EP disclosed
WO-2010078393-A1 KINASE INHIBITORS ALLERGAN, INC. (US) 2010-07-08 WO disclosed