SCHEMBL19251433

SCHEMBL19251433

CCC1=Cc2cccc(Cl)c2S(=O)(=O)N1c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PIK3R1 P27986 8/20 0.36
PIK3CD O00329 7/20 0.36
PIK3CB P42338 4/20 0.34
PIK3CG P48736 4/20 0.34
PIK3CA P42336 2/20 0.34
MAPT P10636 2/20 0.33
RXFP1 Q9HBX9 1/20 0.30

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
SCHEMBL19251427 0.86 MAPT (0.36) MAPT
SCHEMBL19251428 0.85 MAPT (0.33) MAPT
SCHEMBL29109339 0.77 PIK3R1 (0.39) PIK3R1PIK3CDPIK3CBPIK3CGPIK3CA
SCHEMBL29109342 0.77 PIK3R1 (0.39) PIK3R1PIK3CDPIK3CBPIK3CGPIK3CA
SCHEMBL19252635 0.72 PIK3R1 (0.48) PIK3R1PIK3CDPIK3CBPIK3CGPIK3CA
SCHEMBL29109273 0.69 PIK3R1 (0.33) PIK3R1PIK3CDPIK3CBPIK3CGPIK3CA
SCHEMBL29109275 0.69 PIK3R1 (0.33) PIK3R1PIK3CDPIK3CBPIK3CGPIK3CA
SCHEMBL24168172 0.68 KDM4E (0.32) MAPT
SCHEMBL19251435 0.66 GRIA2 (0.32)
SCHEMBL19251425 0.65 LMNA (0.36) PIK3R1PIK3CDMAPT

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-2017133655-A1 BENZOTHIAZINE AND BENZOTHIADIAZINE COMPOUNDS AND PREPARATION AND USE 浙江大学 2017-08-10 WO disclosed