SCHEMBL28189397

SCHEMBL28189397

COCNCC(O)c1ccc(O)c(O)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADRB2 P07550 10/20 0.63
▸ MAPT P10636 9/20 0.63
▸ TDP1 Q9NUW8 9/20 0.63
▸ KDM4E B2RXH2 8/20 0.63
▸ ADRB1 P08588 6/20 0.63
▸ DRD2 P14416 5/20 0.63
▸ MEN1 O00255 5/20 0.63
▸ KMT2A Q03164 5/20 0.63
▸ HSD17B10 Q99714 5/20 0.63
▸ DRD3 P35462 4/20 0.63
▸ TSHR P16473 4/20 0.63
▸ ADRB3 P13945 4/20 0.63
▸ MAPK1 P28482 4/20 0.63
▸ DRD1 P21728 4/20 0.63
▸ MTOR P42345 3/20 0.63
▸ CYP1A2 P05177 3/20 0.63
▸ HIF1A Q16665 3/20 0.63
▸ CYP3A4 P08684 3/20 0.63
▸ ADORA3 P0DMS8 3/20 0.63
▸ ADRA1D P25100 3/20 0.63

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
Hydrochloric Acid SCHEMBL29576463 0.98 ADRB2 (0.64) ADRB2MAPTTDP1KDM4EADRB1
SCHEMBL28529308 0.84 ADRB2 (0.68) ADRB2MAPTTDP1KDM4EADRB1
SCHEMBL8557910 0.82 ADRB2 (0.65) ADRB2MAPTTDP1KDM4EADRB1
SCHEMBL8557913 0.82 ADRB2 (0.65) ADRB2MAPTTDP1KDM4EADRB1
SCHEMBL25100811 0.81 MAPT (0.69) ADRB2MAPTTDP1KDM4EADRB1
SCHEMBL9768173 0.81 MAPT (0.69) ADRB2MAPTTDP1KDM4EADRB1
SCHEMBL3222614 0.81 MAPT (0.69) ADRB2MAPTTDP1KDM4EADRB1
SCHEMBL31530707 0.81 ADRB2 (0.68) ADRB2MAPTTDP1KDM4EADRB1
SCHEMBL31530706 0.81 ADRB2 (0.68) ADRB2MAPTTDP1KDM4EADRB1
Hydrochloric Acid SCHEMBL3216930 0.80 ADRB2 (0.70) ADRB2MAPTTDP1KDM4EADRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111825814-B Catechol amine substance magnetic molecularly imprinted polymer, and preparation method and application thereof 重庆医科大学 2023-03-21 — — CN claimed
CN-112266330-B Methoxyarenol derivative, immunogen, anti-methoxyadrol specific antibody, preparation method and application thereof 长沙博源医疗科技有限公司 2023-02-24 — — CN claimed
CN-114965756-A Method for detecting neurotransmitter substances 康谱维(武汉)医疗科技有限公司 2022-08-30 — — CN claimed
CN-114460188-A Kit for detecting human plasma catecholamine intermediate metabolite and testing method 上海睿质科技有限公司 2022-05-10 — — CN claimed
CN-113933421-A LC-MSMS technology-based method for quantitatively analyzing theanine and metabolites thereof 上海中科新生命生物科技有限公司 2022-01-14 — — CN claimed
CN-113917007-A Kit for detecting human urine catecholamine and intermediate metabolites thereof and test method 上海睿质科技有限公司 2022-01-11 — — CN claimed
CN-113820437-A Method for removing catecholamine and intermediate metabolites thereof from blood plasma and application 上海睿质科技有限公司 2021-12-21 — — CN claimed
CN-113030330-A Method for measuring plasma methoxy adrenaline substances 北京医院 2021-06-25 — — CN claimed
CN-109444415-B Methoxyproterenol luminescent immunoassay kit 郑州安图生物工程股份有限公司 2021-05-28 — — CN claimed
CN-112730699-A Method and kit for detecting catecholamine and metabolites in blood plasma 杭州汉库医学检验所有限公司 2021-04-30 — — CN claimed
CN-112578119-A Methoxy adrenalin luminescence immunoassay kit 郑州安图生物工程股份有限公司 2021-03-30 — — CN claimed
CN-112266330-A Methoxy adrenaline derivative, immunogen, anti-methoxy adrenaline specific antibody, preparation method and application thereof 湖南苏阳医疗科技有限公司 2021-01-26 — — CN claimed
CN-111825814-A Catechol amine substance magnetic molecularly imprinted polymer, and preparation method and application thereof 重庆医科大学 2020-10-27 — — CN claimed
CN-111825814-B Catechol amine substance magnetic molecularly imprinted polymer, and preparation method and application thereof 重庆医科大学 2023-03-21 — — CN disclosed
CN-111825814-B Catechol amine substance magnetic molecularly imprinted polymer, and preparation method and application thereof 重庆医科大学 2023-03-21 — — CN disclosed
CN-115524427-B Detection method of catecholamine hormones 质谱生物科技有限公司 2023-03-10 — — CN disclosed
CN-111024874-A Method for quantitatively detecting catecholamine and metabolites thereof by liquid chromatography-mass spectrometry 上海百趣生物医学科技有限公司 2020-04-17 — — CN disclosed
CN-110672755-A Method for simultaneously determining epinephrine and metabolite thereof based on LC-MC/MS 中国肉类食品综合研究中心 2020-01-10 — — CN disclosed
CN-107478741-A Ultra performance liquid chromatography tandem mass spectrum method that is a kind of while detecting metanephrine and methoxyepinephrine 辽宁润生康泰生物医药科技有限公司 2017-12-15 — — CN disclosed
CN-107353200-A A kind of vanillylmandelic acid (VMA) derivative, its synthetic method and a kind of vanillylmandelic acid (VMA) immunogene, its preparation method and its application 苏州博源医疗科技有限公司 2017-11-17 — — CN disclosed
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