SCHEMBL1747458

SCHEMBL1747458

COC(=O)C(C)c1ccc(O)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.56
ESR2 Q92731 2/20 0.56
HPGD P15428 1/20 0.51
MT-CO2 P00403 1/20 0.51
PDCD1 Q15116 1/20 0.48
CD274 Q9NZQ7 1/20 0.48
PTGS1 P23219 1/20 0.47
PTGS2 P35354 1/20 0.47
CA12 O43570 2/20 0.47
CA1 P00915 2/20 0.47
CA2 P00918 2/20 0.47
CA7 P43166 2/20 0.47
CA9 Q16790 2/20 0.47
CA14 Q9ULX7 2/20 0.47
MMP2 P08253 1/20 0.46
MMP9 P14780 1/20 0.46
MMP13 P45452 1/20 0.46
MAPT P10636 2/20 0.45
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.45

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
SCHEMBL1346074 1.00 ESR1 (0.56) ESR1ESR2HPGDMT-CO2PDCD1
SCHEMBL1345145 1.00 ESR1 (0.56) ESR1ESR2HPGDMT-CO2PDCD1
Butane SCHEMBL27751652 0.93 ESR1 (0.54) ESR1ESR2HPGDMT-CO2PDCD1
SCHEMBL9233704 0.86 ESR1 (0.47) ESR1ESR2HPGDMT-CO2PDCD1
SCHEMBL11130803 0.85 HPGD (0.53) HPGDMT-CO2PTGS1PTGS2MAPT
SCHEMBL12896284 0.85 HPGD (0.53) HPGDMT-CO2PTGS1PTGS2MAPT
SCHEMBL12424105 0.83 HPGD (0.51) HPGDMT-CO2PTGS1PTGS2KMT2A
SCHEMBL30892259 0.82 TDP1 (0.55) MT-CO2PTGS1PTGS2MAPTKMT2A
SCHEMBL722654 0.82 TDP1 (0.55) MT-CO2PTGS1PTGS2MAPTKMT2A
SCHEMBL9236496 0.82 ESR1 (0.47) ESR1ESR2PDCD1CD274PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119613358-A Preparation process of esmolol hydrochloride 广东京豪生物制药有限公司 2025-03-14 CN claimed
CN-118834110-A Tea garden organic fertilizer synergistic microbial agent and preparation method and application thereof 福建省农业科学院资源环境与土壤肥料研究所 2024-10-25 CN claimed
CN-118344217-B Synergistic grease state film coating controlled release fertilizer and application thereof 北京市农林科学院 2024-09-06 CN claimed
CN-118344217-A Synergistic grease state film coating controlled release fertilizer and application thereof 北京市农林科学院 2024-07-16 CN claimed
CN-117865801-A Method for preparing methyl p-hydroxyphenylpropionate by selective hydrogenolysis of zirconium dioxide-supported copper-catalyzed lignin 华南理工大学 2024-04-12 CN claimed
CN-117304043-A Esmolol hydrochloride and preparation of preparation thereof 杭州沐源生物医药科技有限公司 2023-12-29 CN claimed
CN-115433348-B Preparation and application of bio-based polyester and high-barrier film based on p-hydroxy phenylpropionic acid 安徽紫金新材料科技股份有限公司 2023-08-04 CN claimed
CN-115433348-A Preparation and application of p-hydroxyphenylpropionic acid-based bio-based polyester and high-barrier membrane 武汉科技大学 2022-12-06 CN claimed
CN-115152389-A Emission reduction method for ammonia volatilization by nitrogen-reduction co-dispensing urease and biological nitrification inhibitor 四川农业大学 2022-10-11 CN claimed
CN-115136778-A Method for cooperatively applying straw, biological or chemical nitrification inhibitor and nitrogen fertilizer 四川农业大学 2022-10-04 CN claimed
CN-107841462-B Construction and use method of electrochemical controllable bacteria adhesion interface 山东第一医科大学(山东省医学科学院) 2021-07-16 CN claimed
CN-112592274-A Process for synthesizing methyl p-hydroxyphenylpropionate 江苏极易新材料有限公司 2021-04-02 CN claimed
CN-112479877-A Synthesis process of 3- (3-tert-butyl-4-hydroxy) methyl phenylpropionate 江苏极易新材料有限公司 2021-03-12 CN claimed
WO-2020238189-A1 PREPARATION METHOD OF ANTIOXIDANT 3,5-METHYL ESTER 江苏极易新材料有限公司 2020-12-03 WO claimed
CN-110092717-B Preparation method of antioxidant 3, 5-methyl ester 江苏极易新材料有限公司 2020-11-03 CN claimed
CN-111620782-A Preparation method of esmolol hydrochloride intermediate 嘉实(湖南)医药科技有限公司 2020-09-04 CN claimed
CN-111116213-A Dry refractory material 张家港市恒乐阳方高温材料有限公司 2020-05-08 CN claimed
WO-2019184088-A1 COMPOUND AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 深圳翰宇药业股份有限公司 2019-10-03 WO claimed
CN-106196318-A A kind of multi-deck cabinet type air cleaning instrument and method of work thereof 徐州工程学院 2016-12-07 CN claimed
CN-101649069-B Plasticizing, oxidation resistance and thermal stabilization modifying agent of PVC material and preparation method thereof HUBEI JINGXIN CHEMICAL GROUP CO., LTD. (CN) 2012-02-01 CN claimed