SCHEMBL128596

SCHEMBL128596

[CH2]CCN(CCCC)CCCC

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.37
CA1 P00915 2/20 0.37
CA9 Q16790 2/20 0.37
MAPT P10636 1/20 0.35
KDM5A P29375 3/20 0.35
DNM1 Q05193 3/20 0.33
PHF8 Q9UPP1 2/20 0.33
LMNA P02545 1/20 0.33
TSHR P16473 1/20 0.33
KDM4C Q9H3R0 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
ALDH1A1 P00352 1/20 0.32
ALDH2 P05091 1/20 0.32

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
SCHEMBL9367395 1.00 CA12 (0.37) CA12CA1CA9MAPTKDM5A
SCHEMBL21065731 0.97 CA12 (0.36) CA12CA1CA9MAPTKDM5A
SCHEMBL3373345 0.95 CA12 (0.34) CA12CA1CA9MAPTKDM5A
SCHEMBL3480688 0.92 DNM1 (0.43) CA12CA1CA9KDM5ADNM1
SCHEMBL1666490 0.89 DNM1 (0.48) CA12CA1CA9KDM5ADNM1
SCHEMBL9368862 0.89 DNM1 (0.48) CA12CA1CA9KDM5ADNM1
SCHEMBL3371284 0.89 KCNH2 (0.40) CA12CA1CA9MAPTKDM5A
SCHEMBL21065766 0.89 DNM1 (0.42) CA12CA1CA9KDM5ADNM1
SCHEMBL4255495 0.89 CA12 (0.34) CA12CA1CA9MAPTDNM1
SCHEMBL5981812 0.89 DNM1 (0.48) CA12CA1CA9KDM5ADNM1

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 1379 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118221577-A 2-Phenoxyquinoline derivative, and preparation method and application thereof 湖南中医药大学 2024-06-21 CN claimed
CN-113845485-B Amino acid derivative and preparation method and application thereof 湖南中医药大学 2023-03-14 CN claimed
CN-114907261-A 2-phenylamino quinoline derivative and preparation method and application thereof 湖南中医药大学 2022-08-16 CN claimed
CN-109942499-B Quinazoline derivative and preparation method and application thereof 湖南中医药大学 2022-03-22 CN claimed
CN-111808031-B Ferulic acid derivative and preparation method and application thereof 湖南中医药大学 2022-01-14 CN claimed
CN-111808031-A Ferulic acid derivative and preparation method and application thereof 湖南中医药大学 2020-10-23 CN claimed
US-9725589-B2 Method of preparing acrylic polymers and products produced thereby LUBRIZOL ADVANCED MATERIALS, INC. (US) 2017-08-08 US claimed
US-9512097-B2 Process for the preparation of 3-aroyl-5-aminobenzofuran derivatives LEK PHARMACEUTICALS D.D. (SI) 2016-12-06 US claimed
CN-102108281-B Polishing composition KAO CORP 2015-07-01 CN claimed
CN-103003400-B Polyalkyl (meth) acrylate for improving lubricating oil properties EVONIK ROHMAX ADDITIVES GMBH 2015-05-06 CN claimed
EP-0433805-A1 N-Substituted 3-cyano-4-phenyl-pyrroles BAYER AG (DE) 1991-06-26 EP claimed
US-4914122-A CONTROLLING PLANT DISEASES BAYER AKTIENGESELLSCHAFT (DE) 1990-04-03 US claimed
EP-0327987-A1 1-Aminomethyl-3-(2-fluoro-3-chlorophenyl)-4-cyano-pyrrole derivatives BAYER AG (DE) 1989-08-16 EP claimed
EP-0327977-A1 1-Aminomethyl-3-(2,4-difluor-3-chlorphenyl)-4-cyanopyrroles BAYER AG (DE) 1989-08-16 EP claimed
EP-0281731-A2 1-Aminomethyl-3-aryl-4-cyano-pyrroles BAYER AG (DE) 1988-09-14 EP claimed
US-4656256-A Benzoazoresorcinol dyes containing a quaternized aminoalkylene oxycarbonyl group BASF AKTIENGESELLSCHAFT (DE) 1987-04-07 US claimed
US-4472304-A CARCINOSTATIC NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1984-09-18 US claimed
US-4405426-A Self-curing irradiated blend of epoxy resin and salt of quaternary amino ester of unsaturated acid JAPAN ATOMIC ENERGY RESEARCH INSTITUTE (JP) 1983-09-20 US claimed
US-4136033-A DIAZO COUPLERS SANDOZ LTD. (CH) 1979-01-23 US claimed
US-3933800-A O-SUBSTITUTED OXIMES, MICROBIOCIDES GRUPPO LEPETIT S.P.A. (IT) 1976-01-20 US claimed