SCHEMBL29829907

SCHEMBL29829907

COc1nc(OCC(F)F)c(F)cc1NS(=O)(=O)c1c[nH]c2cc(OC(F)F)ccc12

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 8/20 0.37
PIK3R1 P27986 1/20 0.37
KIT P10721 2/20 0.36
MTOR P42345 3/20 0.34
PIK3CD O00329 1/20 0.34
PIK3CB P42338 1/20 0.34
PIK3CG P48736 1/20 0.34
SCN1A P35498 1/20 0.34
SCN5A Q14524 1/20 0.34
SCN8A Q9UQD0 1/20 0.34
SGK1 O00141 3/20 0.34
MAPT P10636 2/20 0.33
CYP2C9 P11712 1/20 0.33
ALDH1A1 P00352 1/20 0.33
KDR P35968 1/20 0.33
HAT1 O14929 1/20 0.33
EP300 Q09472 1/20 0.33

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
SCHEMBL23610293 1.00 PIK3CA (0.37) PIK3CAPIK3R1KITMTORPIK3CD
SCHEMBL23610282 0.94 MAPT (0.39) SGK1MAPTALDH1A1KDRHAT1
SCHEMBL29829916 0.94 MAPT (0.39) SGK1MAPTALDH1A1KDRHAT1
SCHEMBL29829927 0.88 SLC40A1 (0.38) PIK3CAPIK3CDPIK3CBPIK3CGSGK1
SCHEMBL29829671 0.88 ACLY (0.34) PIK3CAPIK3R1MTORPIK3CDPIK3CB
SCHEMBL21596704 0.88 ACLY (0.34) PIK3CAPIK3R1MTORPIK3CDPIK3CB
SCHEMBL21596699 0.88 SLC40A1 (0.38) PIK3CAPIK3CDPIK3CBPIK3CGSGK1
SCHEMBL21596668 0.88 CYP2C9 (0.34) PIK3CAPIK3R1MTORPIK3CDPIK3CB
SCHEMBL23610276 0.88 MAPT (0.41) PIK3CAPIK3R1KITSGK1MAPT
SCHEMBL29829463 0.88 MAPT (0.41) PIK3CAPIK3R1KITSGK1MAPT

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
CN-112469710-B Pyridyl and pyrazinyl- (aza) indole sulfonamides 优时比制药有限公司 2024-05-14 CN claimed
EP-3810591-B1 PYRIDINYL AND PYRAZINYL-(AZA)INDOLSULFONAMIDES UCB PHARMA GMBH (DE) 2022-08-10 EP claimed
CN-112469710-B Pyridyl and pyrazinyl- (aza) indole sulfonamides 优时比制药有限公司 2024-05-14 CN disclosed