SCHEMBL2594418

SCHEMBL2594418

Nc1c(-c2ccc3scnc3c2)cnc2ccc(S(=O)(=O)C3CCOC3)cc12

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 17/20 0.41
AKT1 P31749 11/20 0.41
MTOR P42345 6/20 0.40
PIK3C3 Q8NEB9 1/20 0.39
PRKDC P78527 1/20 0.37
ATM Q13315 1/20 0.37
ATR Q13535 1/20 0.37
FEN1 P39748 1/20 0.35

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
SCHEMBL2595324 0.90 RIPK2 (0.38) FEN1
SCHEMBL2595613 0.82 RIPK2 (0.35) FEN1
SCHEMBL2585288 0.78 CD38 (0.33)
SCHEMBL2595020 0.77 PDE4B (0.50) FEN1
SCHEMBL2595291 0.76 RIPK3 (0.34) PIK3CAMTORATMATR
SCHEMBL14717191 0.75 RIPK2 (0.66) PIK3CA
SCHEMBL14717733 0.70 RIPK2 (0.64) PIK3CA
SCHEMBL14717804 0.70 RIPK2 (0.64) PIK3CA
SCHEMBL14718741 0.70 RIPK2 (0.64) PIK3CA
SCHEMBL2595583 0.70 RIPK2 (0.36) FEN1

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-2566477-A1 AMINO-QUINOLINES AS KINASE INHIBITORS Glaxo Group Limited (GB) 2013-03-13 EP disclosed
WO-2011140442-A1 AMINO-QUINOLINES AS KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2011-11-10 WO disclosed