SCHEMBL8567635

SCHEMBL8567635

CCO[CH]CCCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA1A P35348 2/20 0.48
SLC6A3 Q01959 2/20 0.48
KCNH2 Q12809 2/20 0.48
CHRM2 P08172 1/20 0.48
HTR1A P08908 1/20 0.48
ADRA2A P08913 1/20 0.48
CHRM1 P11229 1/20 0.48
DRD1 P21728 1/20 0.48
SLC6A2 P23975 1/20 0.48
SLC6A4 P31645 1/20 0.48
OPRM1 P35372 1/20 0.48
DRD3 P35462 1/20 0.48
IDO1 P14902 1/20 0.42
HDAC3 O15379 1/20 0.42
MAPK1 P28482 1/20 0.42
HDAC4 P56524 1/20 0.42
HDAC1 Q13547 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HDAC7 Q8WUI4 1/20 0.42
HDAC2 Q92769 1/20 0.42

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
SCHEMBL1609918 0.88 TP53 (0.41) ADRA1ASLC6A3KCNH2CHRM2HTR1A
SCHEMBL6538484 0.81 KCNH2 (0.51) ADRA1ASLC6A3KCNH2CHRM2HTR1A
SCHEMBL5609739 0.80 CHRM2 (0.47) ADRA1ASLC6A3KCNH2CHRM2HTR1A
SCHEMBL6538967 0.78 KCNH2 (0.51) ADRA1ASLC6A3KCNH2CHRM2HTR1A
SCHEMBL6538944 0.76 KCNH2 (0.54) SLC6A3KCNH2CHRM2ADRA2ACHRM1
SCHEMBL2702507 0.75 MAOB (0.48) KCNH2IDO1TDP1
Butylbenzyl SCHEMBL27800284 0.74 SIGMAR1 (0.47) ADRA1ASLC6A3KCNH2CHRM2HTR1A
SCHEMBL5795177 0.74 CHRM2 (0.48) ADRA1ASLC6A3KCNH2CHRM2HTR1A
SCHEMBL920894 0.73 CETP (0.42) KCNH2SLC6A4IDO1MAPK1SMN1; SMN2
SCHEMBL11723363 0.73 SIGMAR1 (0.48) ADRA1ASLC6A3KCNH2CHRM2HTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109803632-A High performance, high impact strength fragrance emitting accord 国际香料和香精公司 2019-05-24 CN disclosed
CN-109311789-A The method for preparing 2,3- unsaturated alcohol 巴斯夫欧洲公司 2019-02-05 CN disclosed
CN-104546518-B Stable, flowable dioxide/silica gel capsule preparation 国际香料和香精公司 2018-09-21 CN disclosed
CN-107530297-A Microcapsule composition with high performance 国际香料和香精公司 2018-01-02 CN disclosed
CN-104918694-B Essential Oil Encapsulation 奥古斯特科勒纸厂欧洲公司 2017-11-03 CN disclosed
CN-103030538-B There is the spice of Herba Convallariae aromatic 西姆莱斯有限公司 2017-03-01 CN disclosed
CN-105939761-A Extended release fragrance compositions 雅芳产品公司 2016-09-14 CN disclosed
CN-104918694-A Essential Oil Encapsulation KOEHLER AUGUST PAPIERFAB 2015-09-16 CN disclosed
CN-104546518-A Stable, flowable silica capsule formulation INT FLAVORS & FRAGRANCES INC 2015-04-29 CN disclosed
CN-104560398-A Hybrid fragrance encapsulate formulation and method for using the same INT FLAVORS & FRAGRANCES INC 2015-04-29 CN disclosed
CN-103282475-B Fragrance compositions comprising special mixtures of diastereomers of 2-sobutyl-4-methyl-tetrahydro-2h-pyran-4-ol BASF SE 2015-04-15 CN disclosed
CN-103535678-A Use of defined cyclohexenones as agents for the superadditive enhancement of an olfactory impression and fragrance and/or flavor material composition SYMRISE AG 2014-01-29 CN disclosed
CN-103282475-A Fragrance compositions comprising special mixtures of diastereomers of 2-sobutyl-4-methyl-tetrahydro-2h-pyran-4-ol BASF SE 2013-09-04 CN disclosed
CN-100565779-C Fluorescent lamp capable of slowly releasing organic evaporation material at low temperature KONINKL PHILIPS ELECTRONICS NV (NL) 2009-12-02 CN disclosed
CN-101057312-A Fluorescent lamp capable of slow release of organic evaporating materials at low temperature KONINKL PHILIPS ELECTRONICS NV (NL) 2007-10-17 CN disclosed
CN-1878528-A Mixture with wintergreen odor and flavor SYMRISE GMBH & CO KG (DE) 2006-12-13 CN disclosed
CN-1468229-A 1,4-dioxacycloalkane-2-one and 1,4-dioxacyloalkene-2-one. ������������� 2004-01-14 CN disclosed
EP-0843677-A1 4-AMINO-3-ACYLNAPHTHYRIDINE DERIVATIVES YUNGJIN PHARMACEUTICAL CO., LTD. (KR) 1998-05-27 EP disclosed