SCHEMBL17235258

SCHEMBL17235258

C[C@H](Nc1nc(N)ncc1-c1csc(S(C)(=O)=O)n1)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 18/20 0.64
PIK3R1 P27986 14/20 0.64
PIK3CA P42336 3/20 0.56
PIK3CB P42338 3/20 0.56
PIK3CG P48736 3/20 0.56

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
SCHEMBL17235429 1.00 PIK3CD (0.64) PIK3CDPIK3R1PIK3CAPIK3CBPIK3CG
SCHEMBL17235445 0.89 PIK3CD (0.67) PIK3CDPIK3R1PIK3CAPIK3CBPIK3CG
SCHEMBL17235555 0.89 PIK3CD (0.67) PIK3CDPIK3R1PIK3CAPIK3CBPIK3CG
SCHEMBL17235349 0.89 PIK3CD (0.67) PIK3CDPIK3R1PIK3CAPIK3CBPIK3CG
SCHEMBL17235540 0.89 PIK3CD (0.65) PIK3CDPIK3R1PIK3CAPIK3CBPIK3CG
SCHEMBL17235175 0.89 PIK3CD (0.65) PIK3CDPIK3R1PIK3CAPIK3CBPIK3CG
SCHEMBL17235526 0.89 PIK3CD (0.65) PIK3CDPIK3R1PIK3CAPIK3CBPIK3CG
SCHEMBL17235019 0.88 PIK3CD (0.65) PIK3CDPIK3R1PIK3CAPIK3CBPIK3CG
SCHEMBL17235575 0.88 PIK3CD (0.65) PIK3CDPIK3R1PIK3CAPIK3CBPIK3CG
SCHEMBL17235246 0.88 PIK3CD (0.65) PIK3CDPIK3R1PIK3CAPIK3CBPIK3CG

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-2015168079-A1 PYRIMIDINE OR PYRIDINE DERIVATIVES USEFUL AS PI3K INHIBITORS INFINITY PHARMACEUTICALS, INC. (US) 2015-11-05 WO disclosed