SCHEMBL3136028

SCHEMBL3136028

CCC[C@@H](C)C(=O)O

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL17449760 1.00
SCHEMBL29281967 1.00 GABRR1 (0.59)
SCHEMBL5747303 1.00
SCHEMBL148477 1.00
SCHEMBL18093480 0.97
SCHEMBL22115933 0.97
Hydrochloric Acid SCHEMBL10884134 0.97
SCHEMBL8411144 0.97
SCHEMBL4861299 0.97
SCHEMBL18093471 0.97

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119667035-A Method for rapidly detecting chiral substances in white spirit and fermented grains and application 宜宾五粮液股份有限公司 2025-03-21 CN claimed
CN-114646698-B Method for detecting sodium valproate and related substances thereof in sodium valproate injection 西安远大德天药业股份有限公司 2023-09-22 CN claimed
CN-114646698-A Method for detecting sodium valproate and related substances thereof in sodium valproate injection 西安远大德天药业股份有限公司 2022-06-21 CN claimed
CN-119667035-A Method for rapidly detecting chiral substances in white spirit and fermented grains and application 宜宾五粮液股份有限公司 2025-03-21 CN disclosed
CN-119546577-A Modulators of G protein-coupled receptor 88 阿卡蒂亚药品公司 2025-02-28 CN disclosed
CN-112661636-B Acyloxy and hydroxyketone compounds containing 1, 2-trimethyl-3-cyclopentenyl and preparation method thereof 信越化学工业株式会社 2024-08-02 CN disclosed
CN-118265452-A Fungicidal compositions 先正达农作物保护股份公司 2024-06-28 CN disclosed
CN-111348993-B Process for preparing 4-methyl-5-nonene and 4-methyl-5-nonanol 信越化学工业株式会社 2023-11-28 CN disclosed
CN-114646698-B Method for detecting sodium valproate and related substances thereof in sodium valproate injection 西安远大德天药业股份有限公司 2023-09-22 CN disclosed
CN-112852908-B Aureobasidin with weeding effect, and preparation method and determination method thereof 青海省农林科学院 2023-05-19 CN disclosed
US-11530176-B2 Processes for preparing a 2-(1,2,2-trimethyl-3-cyclopentenyl)-2-oxoethyl carboxylate compound and hydroxymethyl 1,2,2-trimethyl-3-cyclopentenyl ketone, and a halomethyl (1,2,2-trimethyl-3-cyclopentenyl) ketone compound SHIN-ETSU CHEMICAL CO., LTD. (JP) 2022-12-20 US disclosed
EP-0355772-A2 Liquid-crystalline copolymer IDEMITSU KOSAN COMPANY LIMITED (JP) 1990-02-28 EP disclosed
EP-0316124-A2 Ethylated avermectins PFIZER INC. (US) 1989-05-17 EP disclosed
EP-0313297-A2 Process for production of avermectin aglycones and cultures therefor PFIZER INC. (US) 1989-04-26 EP disclosed
US-4818807-A Liquid-crystalline polymer IDEMITSU KOSAN CO., LTD. (JP) 1989-04-04 US disclosed
CN-88100649-A Methods for producing avermectin B and cultures thereof 1988-10-26 CN disclosed
EP-0284176-A2 Process for production of avermectins and cultures therefor PFIZER INC. (US) 1988-09-28 EP disclosed
EP-0276103-A2 Process for production of B avermectins and cultures therefor PFIZER INC. (US) 1988-07-27 EP disclosed
EP-0276131-A2 Non-natural demethylavermectins and process therefor PFIZER INC. (US) 1988-07-27 EP disclosed
EP-0258898-A2 Liquid-crystalline polymer IDEMITSU KOSAN COMPANY LIMITED (JP) 1988-03-09 EP disclosed