SCHEMBL456442

SCHEMBL456442

NC(O)CCCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 1/20 0.54
MAOA P21397 1/20 0.50
ANPEP P15144 2/20 0.48
ERAP1 Q9NZ08 2/20 0.48
ERAP2 Q6P179 1/20 0.48
HTR3A P46098 1/20 0.48
MAOB P27338 2/20 0.48
HTR2A P28223 1/20 0.48
S1PR2 O95136 1/20 0.47
S1PR4 O95977 1/20 0.47
S1PR1 P21453 1/20 0.47
S1PR3 Q99500 1/20 0.47
IDO1 P14902 1/20 0.47
HDAC3 O15379 1/20 0.47
MAPK1 P28482 1/20 0.47
ADRA1A P35348 1/20 0.47
HDAC4 P56524 1/20 0.47
SLC6A3 Q01959 1/20 0.47
HDAC1 Q13547 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL7998233 1.00 GRIK1 (0.54) GRIK1MAOAANPEPERAP1ERAP2
SCHEMBL14544283 1.00 GRIK1 (0.54) GRIK1MAOAANPEPERAP1ERAP2
Hydrochloric Acid SCHEMBL326014 0.98 GRIK1 (0.53) GRIK1MAOAANPEPERAP1ERAP2
SCHEMBL5793873 0.92 S1PR2 (0.57) GRIK1MAOAMAOBS1PR2S1PR4
SCHEMBL4282969 0.86 ANPEP (0.57) GRIK1MAOAANPEPERAP1ERAP2
SCHEMBL194645 0.86 ANPEP (0.57) GRIK1MAOAANPEPERAP1ERAP2
SCHEMBL1760865 0.86 ANPEP (0.57) GRIK1MAOAANPEPERAP1ERAP2
Hydrochloric Acid SCHEMBL20590185 0.84 ANPEP (0.55) MAOAANPEPERAP1ERAP2MAOB
Hydrochloric Acid SCHEMBL28675057 0.84 ANPEP (0.55) MAOAANPEPERAP1ERAP2MAOB
Hydrochloric Acid SCHEMBL16988 0.84 ANPEP (0.55) MAOAANPEPERAP1ERAP2MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7652128-B2 Toner composition XEROX CORPORATION (US) 2010-01-26 US claimed
US-20060100300-A1 Toner composition XEROX CORPORATION 2006-05-11 US claimed
US-5403689-A Amide functionality XEROX CORPORATION (US) 1995-04-04 US claimed
EP-0643088-A1 Amino functional polyesters XEROX CORPORATION (US) 1995-03-15 EP claimed
US-5354840-A Functional-amine polyesters XEROX CORPORATION (US) 1994-10-11 US claimed
US-4529384-A Use of cyanoacrylate compounds for dental modeling MDS PRODUCTS, INC. (US) 1985-07-16 US claimed
US-4522984-A WITH E-CAPROLACTONE DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1985-06-11 US claimed
US-4378213-A USING AN ACCELERATOR TO PROMOTE HARDENING MDS PRODUCTS COMPANY, INC. (US) 1983-03-29 US claimed
WO-1982000756-A1 USE OF CYANOACRYLATE COMPOUNDS FOR DENTAL MODELING SEVERY S 1982-03-18 WO claimed
US-4012542-A PRE-CATALYZED POLYESTER, POLYMERIZATION INHIBITOR, METAL SOAP-AROMATIC TERT-AMINE ACCELERATOR FERRO CORPORATION (US) 1977-03-15 US claimed
JP-11286478-A None JP disclosed
JP-7102051-A None JP disclosed
EP-4441121-A1 COATING COMPOSITIONS CONTAINING POLYAMIDEIMIDE POLYMERS Solvay Specialty Polymers USA, LLC (US) 2024-10-09 EP disclosed
WO-2023094632-A1 COATING COMPOSITIONS CONTAINING POLYAMIDEIMIDE POLYMERS SOLVAY SPECIALTY POLYMERS USA, LLC (US) 2023-06-01 WO disclosed
CN-110483492-A Dipeptidyl peptidase i inhibitors ASTRAZENECA AB 2019-11-22 CN disclosed
US-4218550-A Coating compositions GENERAL ELECTRIC COMPANY (US) 1980-08-19 US disclosed
US-4192791-A Highly extended, unsaturated polyester resin syrup composition mixture containing basic aluminum chloride, a shaped article comprised of the cured, cross-linked composition and a process of preparing such article TANNER CHEMICAL COMPANY, INC. (US) 1980-03-11 US disclosed
US-4180612-A Hydantoin-polyester coating compositions GENERAL ELECTRIC COMPANY (US) 1979-12-25 US disclosed
US-4012542-A PRE-CATALYZED POLYESTER, POLYMERIZATION INHIBITOR, METAL SOAP-AROMATIC TERT-AMINE ACCELERATOR FERRO CORPORATION (US) 1977-03-15 US disclosed
US-4007322-A Acrylic anaerobic sealant compositions and method of bonding ACCRABOND CORPORATION (US) 1977-02-08 US disclosed