SCHEMBL8778699

SCHEMBL8778699

CN(C)c1ccncc1.O=S(=O)(O)c1cccc2ccccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM5 P08912 1/20 0.46
CHKA P35790 1/20 0.46
CNR2 P34972 1/20 0.43
CA2 P00918 2/20 0.42
CA9 Q16790 2/20 0.42
CA1 P00915 1/20 0.42
TTR P02766 1/20 0.41
PRSS1 P07477 4/20 0.40
F2 P00734 3/20 0.40
PRSS2 P07478 3/20 0.40
PRSS3 P35030 3/20 0.40
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
RAB9A P51151 1/20 0.40
KMT2A Q03164 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
NOX1 Q9Y5S8 1/20 0.40

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
Trimethylammonium SCHEMBL29177484 0.83 CA1 (0.55) CA2CA9CA1TTRPRSS1
Trimethylammonium SCHEMBL23581573 0.83 CA1 (0.55) CA2CA9CA1TTRPRSS1
Pyridine SCHEMBL1270547 0.82 CA1 (0.50) CA2CA9CA1TTRPRSS1
Pyridine SCHEMBL1270544 0.82 CA1 (0.50) CA2CA9CA1TTRPRSS1
SCHEMBL528465 0.81 CHRM5 (0.50) CHRM5CHKACA2CA9CA1
Methyl Alcohol SCHEMBL28292348 0.79 CA1 (0.59) CA2CA9CA1TTRPRSS1
SCHEMBL30304762 0.79 CA1 (0.63) CA2CA9CA1TTRPRSS1
SCHEMBL4323 0.79 CA1 (0.63) CA2CA9CA1TTRPRSS1
SCHEMBL29358913 0.79 CA1 (0.63) CA2CA9CA1TTRPRSS1
SCHEMBL27719293 0.79 CA1 (0.63) CA2CA9CA1TTRPRSS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0626948-B1 NEW CURING AGENTS/ACCELERATORS FOR EPOXY RESINS, CURABLE COMPOSITIONS AND PROCESSES REILLY IND INC (US) 1997-11-12 EP claimed
US-5420223-A Dimethylaminopyridine salts and epoxy resins for coatings REILLY INDUSTRIES, INC. (US) 1995-05-30 US claimed
EP-0626948-A1 NEW CURING AGENTS/ACCELERATORS FOR EPOXY RESINS, CURABLE COMPOSITIONS AND PROCESSES REILLY INDUSTRIES, INC. (US) 1994-12-07 EP claimed
WO-1993015054-A1 NEW CURING AGENTS/ACCELERATORS FOR EPOXY RESINS, CURABLE COMPOSITIONS AND PROCESSES REILLY INDUSTRIES, INC. (US) 1993-08-05 WO claimed
EP-0626948-B1 NEW CURING AGENTS/ACCELERATORS FOR EPOXY RESINS, CURABLE COMPOSITIONS AND PROCESSES REILLY IND INC (US) 1997-11-12 EP disclosed
US-5420223-A Dimethylaminopyridine salts and epoxy resins for coatings REILLY INDUSTRIES, INC. (US) 1995-05-30 US disclosed
EP-0626948-A1 NEW CURING AGENTS/ACCELERATORS FOR EPOXY RESINS, CURABLE COMPOSITIONS AND PROCESSES REILLY INDUSTRIES, INC. (US) 1994-12-07 EP disclosed
WO-1993015054-A1 NEW CURING AGENTS/ACCELERATORS FOR EPOXY RESINS, CURABLE COMPOSITIONS AND PROCESSES REILLY INDUSTRIES, INC. (US) 1993-08-05 WO disclosed