SCHEMBL3159488

SCHEMBL3159488

CCCCCCCCCCCCOc1ccc(Cl)c2c(=O)c3ccccc3sc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 2/20 0.41
CYP3A4 P08684 2/20 0.41
MAPT P10636 2/20 0.41
NPC1 O15118 1/20 0.41
CYP1A2 P05177 1/20 0.41
HPGD P15428 1/20 0.41
CYP2C19 P33261 1/20 0.41
RAB9A P51151 1/20 0.41
MAOA P21397 10/20 0.39
MAOB P27338 10/20 0.39
CNR1 P21554 2/20 0.39
CNR2 P34972 2/20 0.39
THRA P10827 1/20 0.38
THRB P10828 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
NR1I2 O75469 1/20 0.37
LMNA P02545 1/20 0.37
CHRM2 P08172 1/20 0.37
ADRA2A P08913 1/20 0.37

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
SCHEMBL1615173 1.00 CYP2C9 (0.41) CYP2C9CYP3A4MAPTNPC1CYP1A2
SCHEMBL28557156 0.95 MAPT (0.42) CYP2C9CYP3A4MAPTNPC1CYP1A2
SCHEMBL108341 0.92 MAPT (0.43) CYP2C9CYP3A4MAPTNPC1CYP1A2
SCHEMBL29428465 0.92 MAPT (0.43) CYP2C9CYP3A4MAPTNPC1CYP1A2
SCHEMBL29353913 0.92 MAPT (0.43) CYP2C9CYP3A4MAPTNPC1CYP1A2
SCHEMBL3168684 0.88 MAPT (0.37) CYP2C9CYP3A4MAPTNPC1CYP1A2
SCHEMBL4542129 0.88 MAPT (0.41) CYP2C9CYP3A4MAPTNPC1CYP1A2
SCHEMBL3162878 0.87 MAOA (0.41) CYP2C9CYP3A4MAPTNPC1CYP1A2
SCHEMBL14556883 0.87 MAPT (0.45) CYP2C9CYP3A4MAPTNPC1CYP1A2
SCHEMBL4538122 0.86 NPC1 (0.40) CYP2C9CYP3A4MAPTNPC1CYP1A2

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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1538149-B1 Sulfonium salts as photoinitiators HENKEL AG & CO KGAA (DE) 2010-03-17 EP disclosed
EP-2112147-A1 Sulfonium salts as photoinitiators Henkel AG & Co. KGaA (DE) 2009-10-28 EP disclosed
EP-2112147-A1 Sulfonium salts as photoinitiators Henkel AG & Co. KGaA (DE) 2009-10-28 EP disclosed
EP-2112146-A1 Sulfonium salt photoinitiators and their use Henkel AG & Co. KGaA (DE) 2009-10-28 EP disclosed
EP-2112146-A1 Sulfonium salt photoinitiators and their use Henkel AG & Co. KGaA (DE) 2009-10-28 EP disclosed
CN-100522957-C Sulfonium salt photinitiators and use thereof NAT STARCH CHEM INVEST (US) 2009-08-05 CN disclosed
US-7560219-B2 Arylsulfonium salts of 1-halothioxanthones and 2-decyl-1-tetradecyl bromide as an intermediate for their preparation; UV curable adhesives, sealants, coating compositions, such as printing inks and varnishes, and encapsulants HENKEL AG & CO. KGAA (DE) 2009-07-14 US disclosed
US-7560219-B2 Arylsulfonium salts of 1-halothioxanthones and 2-decyl-1-tetradecyl bromide as an intermediate for their preparation; UV curable adhesives, sealants, coating compositions, such as printing inks and varnishes, and encapsulants HENKEL AG & CO. KGAA (DE) 2009-07-14 US disclosed
US-20070203254-A1 Arylsulfonium salts of 1-halothioxanthones and 2-decyl-1-tetradecyl bromide as an intermediate for their preparation; UV curable adhesives, sealants, coating compositions, such as printing inks and varnishes, and encapsulants NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION 2007-08-30 US disclosed
US-20070203254-A1 Arylsulfonium salts of 1-halothioxanthones and 2-decyl-1-tetradecyl bromide as an intermediate for their preparation; UV curable adhesives, sealants, coating compositions, such as printing inks and varnishes, and encapsulants NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION 2007-08-30 US disclosed
US-7230122-B2 Arylsulfonium salts of 1-halothioxanthones and 2-decyl-1-tetradecyl bromide as an intermediate for their preparation; photocurable adhesive, coating or sealant compositions NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION (US) 2007-06-12 US disclosed
US-7230122-B2 Arylsulfonium salts of 1-halothioxanthones and 2-decyl-1-tetradecyl bromide as an intermediate for their preparation; photocurable adhesive, coating or sealant compositions NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION (US) 2007-06-12 US disclosed
CN-1637052-A Sulfonium salt photinitiators and use thereof NAT STARCH CHEM INVEST (US) 2005-07-13 CN disclosed
EP-1538149-A2 Sulfonium salts as photoinitiators National Starch and Chemical Investment Holding Corporation (US) 2005-06-08 EP disclosed
US-20050095531-A1 Benzophenones substituted with one or more diarylsulfonium groups, used in photocurable adhesive, coating or sealant compositions, especially photocurable hot melt adhesives and a varnishs HENKEL AG & CO. KGAA (DE) 2005-05-05 US disclosed
US-20050095528-A1 Arylsulfonium salts of 1-halothioxanthones and 2-decyl-1-tetradecyl bromide as an intermediate for their preparation; photocurable adhesive, coating or sealant compositions DISPLAY SOURCE ALLIANCE, LLC 2005-05-05 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070203254-A1 Arylsulfonium salts of 1-halothioxanthones and 2-decyl-1-tetradecyl bromide as an intermediate for their preparation; UV curable adhesives, sealants, coating compositions, such as printing inks and varnishes, and encapsulants VCL, DACH1, WDR77 CYP2C9 1519/4885CYP3A4 2418/4885MAPT 347/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.