SCHEMBL2575115

SCHEMBL2575115

C[S+]([O-])c1ccc(Br)cc1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 1/20 0.44
ALDH1A1 P00352 4/20 0.41
ALOX15 P16050 2/20 0.35
MAPK1 P28482 2/20 0.35
CA2 P00918 5/20 0.33
CA1 P00915 3/20 0.33
PLCG1 P19174 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
NOS1 P29475 2/20 0.31
TSHR P16473 1/20 0.31
CES2 O00748 1/20 0.31
CES1 P23141 1/20 0.31
TAAR1 Q96RJ0 1/20 0.30
CA12 O43570 1/20 0.30
CA9 Q16790 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
SCHEMBL22802017 1.00 CYP2A6 (0.44) CYP2A6ALDH1A1ALOX15MAPK1CA2
SCHEMBL8779728 0.85
SCHEMBL2786319 0.77 CYP2A6 (0.50) CYP2A6ALDH1A1ALOX15MAPK1CA2
SCHEMBL17907429 0.77
SCHEMBL7166369 0.77 CYP2A6 (0.50) CYP2A6ALDH1A1ALOX15MAPK1CA2
SCHEMBL254471 0.74 ACHE (0.47) ALDH1A1CA2CA1TDP1TSHR
SCHEMBL280535 0.74 ACHE (0.47) ALDH1A1CA2CA1TDP1TSHR
SCHEMBL1094237 0.74 ACHE (0.47) ALDH1A1CA2CA1TDP1TSHR
SCHEMBL19903213 0.74 CYP2A6 (0.35) CYP2A6ALDH1A1TSHRTAAR1
SCHEMBL10200928 0.72 MEN1 (0.44) ALDH1A1ALOX15MAPK1CA2CA1

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 211 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114420849-B Method for improving efficiency and stability of tin-lead alloy perovskite battery 青岛科技大学 2025-01-07 CN claimed
CN-114420849-A Method for improving efficiency and stability of tin-lead alloy perovskite battery 青岛科技大学 2022-04-29 CN claimed
US-20090286097-A1 Electrically conducting poylmer glue, devices made therewith and methods of manufacture THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2009-11-19 US claimed
JP-2009500832-A 2009-01-08 JP claimed
EP-1900009-A2 ELECTRICALLY CONDUCTING POLYMER GLUE, DEVICES MADE THEREWITH AND METHODS OF MANUFACTURE The Regents of the University of California (US) 2008-03-19 EP claimed
WO-2007005617-A2 ELECTRICALLY CONDUCTING POLYMER GLUE, DEVICES MADE THEREWITH AND METHODS OF MANUFACTURE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2007-01-11 WO claimed
CN-1176976-C High-molecular hole conduction material and its preparing process 中国科学院长春应用化学研究所 2004-11-24 CN claimed
CN-1381513-A High-molecular hole conduction material and its preparing process CHANGCHUN APPLIED CHEMISTRY (CN) 2002-11-27 CN claimed
CN-119685854-A Catalyst for preparing sulfone, preparation method thereof and application of catalyst in preparing sulfone by electrocatalytic oxidation of sulfoxide 齐鲁工业大学(山东省科学院) 2025-03-25 CN disclosed
WO-2025049495-A1 TERTIARY PYRIDYL AMINE MODULATORS OF CHOLESTEROL BIOSYNTHESIS AND THEIR USE FOR PROMOTING REMYLINATION GENENTECH, INC. (US) 2025-03-06 WO disclosed
CN-114420849-B Method for improving efficiency and stability of tin-lead alloy perovskite battery 青岛科技大学 2025-01-07 CN disclosed
CN-118994163-A Compounds containing a fused ring structure 正大天晴药业集团股份有限公司 2024-11-22 CN disclosed
CN-118678843-A Method for improving performance of tin-lead mixed perovskite solar cell 上海空间电源研究所 2024-09-20 CN disclosed
CN-118237077-A Application of madder serving as photocatalyst in catalyzing organic oxidation reaction 江苏省中国科学院植物研究所 2024-06-25 CN disclosed
EP-0661258-A1 Biaromatic propynyl compounds, pharmaceutical compositions and cosmetics containing them and their uses CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA, ( CIRD GALDERMA) (FR) 1995-07-05 EP disclosed
US-5356893-A Antidepressants, nervous system disorders GLAXO GROUP LIMITED (GB) 1994-10-18 US disclosed
CN-1089944-A The N-Benzanilide derivatives GLAXO GROUP LTD (GB) 1994-07-27 CN disclosed
CN-1071922-A The N-Benzanilide derivatives GLAXO GROUP LTD (GB) 1993-05-12 CN disclosed
EP-0533266-A1 Benzanilide derivatives as 5-HT1D antagonists GLAXO GROUP LIMITED (GB) 1993-03-24 EP disclosed
US-5140026-A N-aminoalkyl-S-aryl-S-alkyl (or substituted alkyl) sulfoximines as antiarrhythmic agents A. H. ROBINS COMPANY, INCORPORATED (US) 1992-08-18 US disclosed