SCHEMBL588491

SCHEMBL588491

Cc1cnc(Nc2ccc(S(C)(=O)=O)cc2)nc1Nc1ccc2c(C)n[nH]c2c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 11/20 0.64
JAK1 P23458 11/20 0.64
CDK2 P24941 2/20 0.52
CCNA2 P20248 1/20 0.52
SYK P43405 2/20 0.47
AURKA O14965 2/20 0.46
PDGFRB P09619 5/20 0.45
PDGFRA P16234 5/20 0.45
JAK2 O60674 2/20 0.45
CDC7 O00311 1/20 0.45
PLK4 O00444 1/20 0.45
CHEK1 O14757 1/20 0.45
DCLK1 O15075 1/20 0.45
PDPK1 O15530 1/20 0.45
DAPK3 O43293 1/20 0.45
ROCK2 O75116 1/20 0.45
MAP4K4 O95819 1/20 0.45
PAK4 O96013 1/20 0.45
CHEK2 O96017 1/20 0.45
ABL1 P00519 1/20 0.45

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
SCHEMBL588639 0.91 JAK1 (0.66) JAK3JAK1CDK2SYKAURKA
SCHEMBL588761 0.84 PKMYT1 (0.59) JAK3JAK1CDK2SYKAURKA
SCHEMBL589265 0.79 SYK (0.48) JAK3JAK1SYKAURKAPDGFRB
SCHEMBL341021 0.79 JAK1 (0.69) JAK3JAK1SYKJAK2TYK2
SCHEMBL29609942 0.79 JAK1 (0.69) JAK3JAK1SYKJAK2TYK2
SCHEMBL24625492 0.79 EGFR (0.68) PDGFRBPDGFRAEGFRBRD4
SCHEMBL29793664 0.79 EGFR (0.68) PDGFRBPDGFRAEGFRBRD4
SCHEMBL31299815 0.78 JAK3 (0.45) JAK3JAK1CDK2CCNA2SYK
SCHEMBL31672493 0.76 PAK1 (0.48) JAK3JAK1CDK2CCNA2CDK1
SCHEMBL2873675 0.76 PAK1 (0.48) JAK3JAK1CDK2CCNA2CDK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2311825-A1 Pyrimidineamines as angiogenesis modulators GlaxoSmithKline LLC (US) 2011-04-20 EP claimed
US-8114885-B2 Pazopanib hydrochloride and synthesis, chemical intermediates, and dosage forms thereof; anticancer; colon cancer, breast cancer GLAXOSMITHKLINE LLC (US) 2012-02-14 US disclosed
EP-2311825-A1 Pyrimidineamines as angiogenesis modulators GlaxoSmithKline LLC (US) 2011-04-20 EP disclosed