SCHEMBL807202

SCHEMBL807202

C=S(=O)(Nc1cc(B2OC(C)(C)C(C)(C)O2)cnc1OC)c1ccc(F)cc1F

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALPL P05186 1/20 0.49
PIK3CA P42336 17/20 0.43
MTOR P42345 11/20 0.43
PIK3R1 P27986 4/20 0.43
PIK3CG P48736 4/20 0.43
PIK3CD O00329 3/20 0.43
PIK3CB P42338 3/20 0.43
PRF1 P14222 1/20 0.42
PI4KA P42356 1/20 0.42

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
SCHEMBL29434933 0.90 ALPL (0.55) ALPLPIK3CAMTORPIK3R1PIK3CG
SCHEMBL110313 0.90 ALPL (0.55) ALPLPIK3CAMTORPIK3R1PIK3CG
SCHEMBL29556110 0.90 ALPL (0.55) ALPLPIK3CAMTORPIK3R1PIK3CG
SCHEMBL30333601 0.82 ALPL (0.54) ALPLPIK3CAMTORPIK3R1PIK3CG
SCHEMBL18759850 0.82 ALPL (0.54) ALPLPIK3CAMTORPIK3R1PIK3CG
SCHEMBL15559069 0.82 ALPL (0.52) ALPLPIK3CAMTORPIK3R1PIK3CG
SCHEMBL22447700 0.81 ALPL (0.52) ALPLPIK3CAMTORPIK3R1PIK3CG
SCHEMBL9953720 0.81 ALPL (0.62) ALPLPIK3CAMTORPIK3R1PIK3CG
SCHEMBL798076 0.80 ALPL (0.47) ALPLPIK3CAMTORPIK3R1PIK3CG
SCHEMBL15560224 0.80 ALPL (0.58) ALPLPIK3CAMTORPIK3R1PIK3CG

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
WO-2012037108-A1 AMINOQUINOLINE DERIVATIVES AS ANTIVIRAL AGENTS GLAXOSMITHKLINE LLC (US) 2012-03-22 WO disclosed