SCHEMBL6512446

SCHEMBL6512446

CC(=O)C(C[N+](C)(C)C)OS

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 4/20 0.43
CHRM2 P08172 3/20 0.43
CHRM4 P08173 3/20 0.43
TSHR P16473 2/20 0.43
TBXA2R P21731 2/20 0.43
MAPT P10636 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
GALR3 O60755 2/20 0.42
BLM P54132 1/20 0.42
LMNA P02545 3/20 0.38
CHRM5 P08912 3/20 0.38
CHRM3 P20309 3/20 0.38
CYP2C9 P11712 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
CYP1A2 P05177 1/20 0.37
HRH1 P35367 1/20 0.37
SLC22A16 Q86VW1 1/20 0.35
CPT2 P23786 1/20 0.33
CPT1A P50416 1/20 0.33

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
SCHEMBL4252480 0.79 CHRM1 (0.45) CHRM1CHRM2CHRM4TSHRTBXA2R
SCHEMBL4783813 0.77 CHRM1 (0.59) CHRM1CHRM2CHRM4TSHRTBXA2R
Bromide SCHEMBL8759877 0.77 CHRM1 (0.43) CHRM1CHRM2CHRM4TSHRTBXA2R
Hydrochloric Acid SCHEMBL16637634 0.77 MAPT (0.47) CHRM1CHRM2CHRM4TSHRTBXA2R
Iodide SCHEMBL27443982 0.76 CHRM1 (0.57) CHRM1CHRM2CHRM4TSHRTBXA2R
SCHEMBL27607678 0.76 CHRM2 (0.42) CHRM1CHRM2CHRM4TSHRTBXA2R
Hydrochloric Acid SCHEMBL28364686 0.76 MAPT (0.61) CHRM1CHRM2CHRM4TSHRTBXA2R
Hydrochloric Acid SCHEMBL10633363 0.76 MAPT (0.61) CHRM1CHRM2CHRM4TSHRTBXA2R
SCHEMBL28114484 0.72 MEN1 (0.51) CHRM1CHRM2CHRM4TSHRTBXA2R
Phosphoric Acid SCHEMBL29285420 0.71 CHRM1 (0.52) CHRM1CHRM2CHRM4TSHRTBXA2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105343191-B Application of the Jasminum nervosum Lour extract in preparation acetylcholinesterase inhibitor 广西中医药大学 2019-06-07 CN disclosed
CN-106905317-B 4- replaces Sampangine alcaloid-derivatives and its synthetic method and application 广西师范大学 2019-03-22 CN disclosed
CN-109456328-A 11- replaces 1,6- diaza benzo anthracyclinone derivatives and its synthetic method and application 广西师范大学 2019-03-12 CN disclosed
CN-109438445-A 8- replaces 1,6- diaza benzo anthracyclinone derivatives and its synthetic method and application 广西师范大学 2019-03-08 CN disclosed
CN-107513084-A White crane rattan alkali and its extracting method and application thereof 广西中医药大学 2017-12-26 CN disclosed
CN-106038564-A Application of 11-substituted oxoisoaporphine derivatives 广西师范大学 2016-10-26 CN disclosed
CN-105998022-A Application of 8-substituted oxoisoaporphine derivatives 广西师范大学 2016-10-12 CN disclosed
CN-104327075-B A kind of 9-amino substituted pyridines Acridine derivatives and its production and use 广西中医药大学 2016-08-24 CN disclosed
CN-103923009-B 8-replaces the different aporphine derivative of oxidation and synthetic method and application GUANGXI NORMAL UNIVERSITY (CN) 2016-03-23 CN disclosed
CN-103923010-B 11-replaces the different aporphine derivative of oxidation and synthetic method and application GUANGXI NORMAL UNIVERSITY (CN) 2016-03-23 CN disclosed
CN-103923009-A 8-substitued oxoisoaporphine derivatives as well as synthetic method and application thereof UNIV GUANGXI NORMAL 2014-07-16 CN disclosed
CN-103923010-A 11-replaced oxoisoaporphine derivatives as well as synthetic method and application thereof UNIV GUANGXI NORMAL 2014-07-16 CN disclosed
CN-102408395-A Novel piperazine and homopiperazine derivatives, preparation method and application thereof UNIV GUANGXI NORMAL 2012-04-11 CN disclosed
CN-101597294-B 3-aminoalkaneacylamino-rutaecarpine and 3-aminoalkaneacylamino-7,8-dehydrorutaecarpine derivative UNIV SUN YAT SEN 2011-09-07 CN disclosed
CN-101575341-B Amidocyanogen amido xanthone pyridine derivant, and preparation method and application thereof UNIV GUANGXI NORMAL 2011-04-27 CN disclosed
CN-101020659-B 9-aminoalkylamido-1-azabenznthrone derivative and its synthesis and application UNIV SUN YAT SEN 2010-06-23 CN disclosed
CN-101597294-A 3-amidocyanogen amido-Rutaecarpine and 3-amidocyanogen amido-7,8-dehydrogenation Rutaecarpine derivative UNIV SUN YAT SEN (CN) 2009-12-09 CN disclosed
CN-101575341-A Amidocyanogen amido xanthone pyridine derivant, and preparation method and application thereof UNIV GUANGXI NORMAL (CN) 2009-11-11 CN disclosed
CN-101020659-A 9-aminoalkylamido-1-azabenznthrone derivative and its synthesis and application UNIV SUN YAT SEN (CN) 2007-08-22 CN disclosed
US-20050176118-A1 Esterases with lipase activity COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2005-08-11 US disclosed