SCHEMBL14713178

SCHEMBL14713178

CC#Cc1cncc(C(=O)N=S(C)(=O)c2cc(Cl)cc(Cl)c2)c1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDR P35968 15/20 0.42
PDGFRB P09619 10/20 0.42
MAPT P10636 1/20 0.35
SAE1 Q9UBE0 1/20 0.35
UBA2 Q9UBT2 1/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.34
PTGS1 P23219 1/20 0.32
PTGS2 P35354 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL14713166 0.89 KDR (0.44) KDRPDGFRBPTGDR2PTGS1PTGS2
SCHEMBL14713208 0.89 KDR (0.46) KDRPDGFRBPTGDR2
SCHEMBL834682 0.88 KDR (0.45) KDRPDGFRBPTGDR2PTGS1PTGS2
SCHEMBL14713211 0.88 KDR (0.48) KDRPDGFRBPTGS2
SCHEMBL1479033 0.87 KDR (0.49) KDRPDGFRBMAPTPTGDR2
SCHEMBL834903 0.87 KDR (0.40) KDRPDGFRBMAPTSAE1UBA2
SCHEMBL833449 0.86 KDR (0.44) KDRPDGFRBMAPTSAE1UBA2
SCHEMBL834498 0.86 KDR (0.52) KDRPDGFRBPTGDR2PTGS2
SCHEMBL836827 0.85 MAPT (0.42) KDRPDGFRBMAPTSAE1UBA2
SCHEMBL834677 0.85 KDR (0.43) KDRPDGFRBMAPTPTGDR2PTGS1

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
US-8383825-B2 Kinase inhibitors ALLERGAN, INC. (US) 2013-02-26 US disclosed