SCHEMBL3243083

SCHEMBL3243083

CCCCCCC(C)C(=O)OC(C)(C)C

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.50
ACE2 Q9BYF1 1/20 0.46
ZDHHC7 Q9NXF8 1/20 0.44
CA2 P00918 1/20 0.43
FAAH O00519 1/20 0.42
SMPD1 P17405 3/20 0.42
FFAR1 O14842 2/20 0.42
FFAR4 Q5NUL3 1/20 0.42
GPR84 Q9NQS5 3/20 0.41
FDPS P14324 3/20 0.41
CTSK P43235 1/20 0.41
MAPT P10636 1/20 0.40

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
SCHEMBL7373633 1.00 CA1 (0.50) CA1ACE2ZDHHC7CA2FAAH
SCHEMBL28521007 1.00 CA1 (0.50) CA1ACE2ZDHHC7CA2FAAH
SCHEMBL27839292 1.00 CA1 (0.50) CA1ACE2ZDHHC7CA2FAAH
SCHEMBL29843712 1.00 CA1 (0.50) CA1ACE2ZDHHC7CA2FAAH
SCHEMBL7255990 1.00 CA1 (0.50) CA1ACE2ZDHHC7CA2FAAH
SCHEMBL28907776 1.00 CA1 (0.50) CA1ACE2ZDHHC7CA2FAAH
SCHEMBL30176799 0.98 CA1 (0.48) CA1ACE2ZDHHC7CA2FAAH
Hydrochloric Acid SCHEMBL28750117 0.98 CA1 (0.48) CA1ACE2ZDHHC7CA2FAAH
Hydrochloric Acid SCHEMBL27747957 0.98 CA1 (0.48) CA1ACE2ZDHHC7CA2FAAH
Hydrochloric Acid SCHEMBL27857053 0.98 CA1 (0.48) CA1ACE2ZDHHC7CA2FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113423711-B Thieno [3,2-B ] pyridine derivatives as UDP glycosyltransferase inhibitors and methods of use thereof 建新公司 2024-03-15 CN claimed
CN-111892599-B Synthesis method of 2,5-diazabicyclo [2.2.2] octane-2-tert-butyl carboxylate 黄芳(CN) 2023-01-13 CN claimed
CN-115315424-A 2-methyl-aza-quinazolines 拜耳公司 2022-11-08 CN claimed
CN-109661396-B Spiro-fused cyclic ureas as ROCK inhibitors 百时美施贵宝公司 2022-07-01 CN claimed
CN-114667145-A Molecules that bind to TDP-43 for the treatment of amyotrophic lateral sclerosis and related disorders 拜尔哈文制药股份有限公司 2022-06-24 CN claimed
CN-113135921-B Dihydropyrimidine-spiro derivative and preparation method and application thereof 山东大学 2022-06-17 CN claimed
CN-113135921-A Dihydropyrimidine-spiro derivative and preparation method and application thereof 山东大学 2021-07-20 CN claimed
CN-109415371-B 2-amido thiazole derivative and preparation method and application thereof 四川科伦博泰生物医药股份有限公司 2021-07-09 CN claimed
CN-112574085-A Preparation method of 5-amino-2-azaspiro [3.4] octane-2-carboxylic acid tert-butyl ester 南通药明康德医药科技有限公司 2021-03-30 CN claimed
CN-111892599-A Synthesis method of 2, 5-diazabicyclo [2.2.2] octane-2-carboxylic acid tert-butyl ester 黄芳 2020-11-06 CN claimed
CN-109415371-A Novel 2-acylamino thiazole derivative and preparation method and application thereof 四川科伦博泰生物医药股份有限公司 2019-03-01 CN claimed
CN-106517049-B 360 ° of large parts turnover devices of one kind and its working method 江苏建筑职业技术学院 2018-07-20 CN claimed
CN-107873023-A 3-alkyl-4-amido-bicyclo [4, 5, 0] hydroxamic acids as HDAC inhibitors 福马治疗股份有限公司 2018-04-03 CN claimed
CN-118344370-A Isoindolinone and indazole compounds for EGFR degradation C4医药公司 2024-07-16 CN disclosed
CN-112867712-B Carboxamide as ubiquitin-specific protease inhibitor 瓦洛早期发现股份有限公司 2024-07-16 CN disclosed
CN-115297861-B Compounds and uses thereof 福宏治疗公司 2024-07-12 CN disclosed
EP-0411460-B1 Perfumery composition comprising 2-cyclohexylpropionic acid or its derivative KAO CORP (JP) 1995-03-22 EP disclosed
US-5049544-A Perfumery composition comprising 2-cyclohexylpropionic acid or its derivative KAO CORPORATION (JP) 1991-09-17 US disclosed
EP-0411460-A1 Perfumery composition comprising 2-cyclohexylpropionic acid or its derivative KAO CORPORATION (JP) 1991-02-06 EP disclosed
CN-86105905-A Process for the preparation of cephalosporin nucleus derivatives and their use in medicaments 1987-07-29 CN disclosed