SCHEMBL11096837

SCHEMBL11096837

CCN(CC)CC.CN(C)c1ccncc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM5 P08912 1/20 0.73
CHKA P35790 1/20 0.73
MAPT P10636 3/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
ALOX15 P16050 3/20 0.50
MEN1 O00255 1/20 0.50
NPC1 O15118 1/20 0.50
CASP1 P29466 1/20 0.50
RAB9A P51151 1/20 0.50
HBB P68871 1/20 0.50
KMT2A Q03164 1/20 0.50
ALDH1A1 P00352 4/20 0.43
TSHR P16473 3/20 0.43
HSD17B10 Q99714 1/20 0.43
CYP3A4 P08684 1/20 0.39
MAPK1 P28482 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
KDM4E B2RXH2 2/20 0.39
SLC6A2 P23975 1/20 0.38
CYP2A6 P11509 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
SCHEMBL8781228 0.89 CHRM5 (0.57) CHRM5CHKAMAPTSMN1; SMN2ALOX15
SCHEMBL189 0.85
SCHEMBL8664726 0.85 CHRM5 (1.00) CHRM5CHKAMAPTSMN1; SMN2ALOX15
SCHEMBL9135564 0.84 CHRM5 (0.70) CHRM5CHKAMAPTSMN1; SMN2ALOX15
Alcohol SCHEMBL25433719 0.84 CHRM5 (0.76) CHRM5CHKAMAPTSMN1; SMN2ALOX15
Butane SCHEMBL29281770 0.84 CHRM5 (0.76) CHRM5CHKAMAPTSMN1; SMN2ALOX15
Hydrochloric Acid SCHEMBL9013636 0.83 CHRM5 (0.94) CHRM5CHKAMAPTSMN1; SMN2ALOX15
SCHEMBL2277093 0.83 CHRM5 (0.94) CHRM5CHKAMAPTSMN1; SMN2ALOX15
SCHEMBL4405649 0.83 CHRM5 (0.94) CHRM5CHKAMAPTSMN1; SMN2ALOX15
Bromide SCHEMBL393564 0.83 CHRM5 (0.94) CHRM5CHKAMAPTSMN1; SMN2ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112370537-A Double-targeting magnetic fluorescent nano-microsphere, preparation method thereof and application thereof in circulating tumor cells of liver cancer 大连理工大学 2021-02-19 CN claimed
CN-108794705-A A kind of preparation method and application of modified carboxyl styrene-butadiene latex 江南大学 2018-11-13 CN claimed
CN-112370537-B Double-targeting magnetic fluorescent nanoparticle, preparation method thereof and application thereof in liver cancer circulating tumor cells 大连理工大学 2023-08-11 CN disclosed
CN-112370537-A Double-targeting magnetic fluorescent nano-microsphere, preparation method thereof and application thereof in circulating tumor cells of liver cancer 大连理工大学 2021-02-19 CN disclosed
CN-110352006-A PICOLINAMIDES AS FUNGICIDES 美国陶氏益农公司 2019-10-18 CN disclosed
CN-108794705-A A kind of preparation method and application of modified carboxyl styrene-butadiene latex 江南大学 2018-11-13 CN disclosed
CN-104496901-B The manufacture method of anthranilamide compound ISHIHARA SANGYO KAISHA, LTD. (JP) 2016-05-25 CN disclosed
CN-102101839-B Polycarbonate with improved thermal and mechanical properties and reduced thermal expansion coefficient BAYER MATERIALSCIENCE AG 2014-12-24 CN disclosed
CN-102227463-A Copolycarbonates with improved surface hardness BAYER MATERIALSCIENCE AG 2011-10-26 CN disclosed
CN-102101839-A Polycarbonate with improved thermal and mechanical properties and reduced thermal expansion coefficient BAYER MATERIALSCIENCE AG 2011-06-22 CN disclosed
CN-102093685-A Polycarbonate compositions with improved surface hardness BAYER MATERIALSCIENCE AG 2011-06-15 CN disclosed
CN-1128790-C 4-hydroxyquinoline-3-carboxamides and hydrazides as antiviral agents UPJOHN CO (US) 2003-11-26 CN disclosed
CN-1281439-A 4-hydroxyquinoline-3-carboxamide and hydrazide compounds as antiviral agents UPJOHN CO (US) 2001-01-24 CN disclosed
CN-1046736-C As steroids C17-20Delta of lyase inhibitors16Unsaturated C17Heterocyclic steroids MERRELL DOW PHARMA (US) 1999-11-24 CN disclosed
CN-1133596-A 'Delta' 16 unsaturated C17 heterocyclic steroids useful as steroid C17-20 lyase inhibitors MERRELL DOW PHARMA (US) 1996-10-16 CN disclosed
CN-1028477-C Microbicide composition containing thiazolyl-5-carboxamide derivatives CIBA GEIGY AG (CH) 1995-05-24 CN disclosed
CN-1052675-A Insecticides CIBA GEIGY AG (CH) 1991-07-03 CN disclosed
EP-0032400-B1 (3SR, 4RS)-3-((RS)-1-HYDROXYETHYL)- AND -((RS)-1-ACYLOXYETHYL)-2-OXO-4-AZETIDINEACETIC ACID COMPOUNDS AND A PROCESS FOR PREPARING THE SAME MERCK & CO. INC. (US) 1984-06-20 EP disclosed
US-4287123-A Synthesis of thienamycin via (3SR, 4RS)-3-((RS)-1-acyloxyethyl)-2-oxo-4-azetidineacetate MERCK & CO., INC. (US) 1981-09-01 US disclosed
EP-0032400-A1 (3SR, 4RS)-3-((RS)-1-hydroxyethyl)- and -((RS)-1-acyloxyethyl)-2-oxo-4-azetidineacetic acid compounds and a process for preparing the same MERCK & CO. INC. (US) 1981-07-22 EP disclosed