SCHEMBL20680705

SCHEMBL20680705

COc1ncc(Br)cc1S(=O)(=O)Nc1cncc(Cl)c1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALPL P05186 17/20 0.48
SHMT2 P34897 1/20 0.46
PIK3CD O00329 1/20 0.45
PIK3R1 P27986 1/20 0.45
PIK3CA P42336 1/20 0.45
PIK3CB P42338 1/20 0.45
PIK3CG P48736 1/20 0.45
MEN1 O00255 1/20 0.45
POLB P06746 1/20 0.45
KMT2A Q03164 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
SCHEMBL20680164 0.90 ALPL (0.48) ALPLPIK3CDPIK3R1PIK3CAPIK3CB
SCHEMBL20680161 0.88 KMT2A (0.51) ALPLSHMT2MEN1KMT2A
SCHEMBL20680421 0.83 ALPL (0.60) ALPLSHMT2MEN1POLBKMT2A
SCHEMBL9954777 0.80 PIK3CD (0.56) ALPLSHMT2PIK3CDPIK3R1PIK3CA
SCHEMBL19211730 0.80 SHMT2 (0.51) ALPLSHMT2PIK3CDPIK3R1PIK3CA
SCHEMBL9953447 0.79 SHMT2 (0.49) ALPLSHMT2PIK3CDPIK3R1PIK3CA
SCHEMBL806771 0.79 SHMT2 (0.55) ALPLSHMT2MEN1KMT2A
SCHEMBL9953524 0.78 SHMT2 (0.54) ALPLSHMT2PIK3CDPIK3R1PIK3CA
SCHEMBL20680714 0.77 PIK3CD (0.67) ALPLPIK3CDPIK3R1PIK3CAPIK3CB
SCHEMBL16996889 0.77 PIK3C3 (0.59) SHMT2MEN1POLBKMT2A

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
WO-2019020657-A1 PYRIDINE-3-SULFONAMIDE COMPOUNDS AS PI3-KINASE INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-01-31 WO disclosed
WO-2019020657-A1 PYRIDINE-3-SULFONAMIDE COMPOUNDS AS PI3-KINASE INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-01-31 WO disclosed