SCHEMBL431680

SCHEMBL431680

CC(=O)OC(C)=O.[KH]

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
SCHEMBL7532829 1.00
SCHEMBL28995029 0.96
SCHEMBL2946496 0.96
SCHEMBL4739462 0.96
SCHEMBL1331977 0.95
SCHEMBL523 0.95
SCHEMBL5305593 0.95 ALDH1A1 (1.00)
SCHEMBL9866292 0.95
SCHEMBL1331774 0.95
SCHEMBL1330344 0.95

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-109400655-A The preparation method and schiff base metal cobalt complex of a kind of schiff base metal cobalt complex are preparing the application in R- propylene glycol 潍坊汇韬化工有限公司 2019-03-01 CN claimed
CN-104402920-B A kind of method for synthesizing the chloroaniline of 2 halo, 3 pinacol borate 5 河南科技学院 2018-04-03 CN claimed
CN-107814824-A A kind of preparation method of 21-hydroxy-1,4,9(11),16-pregnatetraene-3,20-dione-21-acetate 浙江仙琚制药股份有限公司 2018-03-20 CN claimed
CN-105503924-B A kind of synthesis N replaces the method for the borate of 1,2,3,6 tetrahydropyridine 5 沧州普瑞东方科技有限公司 2017-05-31 CN claimed
CN-1800134-A Diacetyl rhein preparation method TAIZHOU HAICHEN MEDICINAL CHEM (CN) 2006-07-12 CN claimed
CN-1146574-C Synthesis method of pregnen ketoalcohol compound 中国科学院上海有机化学研究所 2004-04-21 CN claimed
CN-1341603-A Synthesis method of pregnen ketoalcohol compound SHANGHAI INST ORGANIC CHEMISTR (CN) 2002-03-27 CN claimed
US-12215184-B2 Polyol or polythiol compound, preparation method therefor, transparent polyurethane-based resin prepared therefrom, and optical body KIM, KEUN SIK (KR) 2025-02-04 US disclosed
US-20240052089-A1 POLYOL OR POLYTHIOL COMPOUND, PREPARATION METHOD THEREFOR, TRANSPARENT POLYURETHANE-BASED RESIN PREPARED THEREFROM, AND OPTICAL BODY KIM, KEUN SIK (KR) 2024-02-15 US disclosed
CN-114160157-B Method for supplementing potassium acetate auxiliary agent 北京水木滨华科技有限公司 2022-09-16 CN disclosed
CN-114160157-A Method for supplementing potassium acetate auxiliary agent 北京水木滨华科技有限公司 2022-03-11 CN disclosed
US-20200031986-A1 POLYOL OR POLYTHIOL COMPOUND, PREPARATION METHOD THEREFOR, TRANSPARENT POLYURETHANE-BASED RESIN PREPARED THEREFROM, AND OPTICAL BODY Kim, Keun Sik (KR) 2020-01-30 US disclosed
CN-110452182-A A kind of host compound and the organic electroluminescence device using the compound ZHEJIANG UIVOLED PHOTOELECTRIC TECH CO LTD 2019-11-15 CN disclosed
CN-1341603-A Synthesis method of pregnen ketoalcohol compound SHANGHAI INST ORGANIC CHEMISTR (CN) 2002-03-27 CN disclosed
US-20010036755-A1 Method of fabricating semiconductor device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2001-11-01 US disclosed
EP-1064338-A1 CHEMICAL MECHANICAL POLISHING SLURRY USEFUL FOR COPPER SUBSTRATES CABOT CORPORATION (US) 2001-01-03 EP disclosed
EP-1055952-A2 Goggle type display device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2000-11-29 EP disclosed
WO-1999047618-A1 CHEMICAL MECHANICAL POLISHING SLURRY USEFUL FOR COPPER SUBSTRATES CABOT CORPORATION (US) 1999-09-23 WO disclosed
CN-1204337-A Production of salt clavulanic acid BIOCHEMIE GMBH (AT) 1999-01-06 CN disclosed
US-5302743-A Reacting N-protected L-aspartic anhydride with L-phenylalanine methyl ester salt in non-aqueous solvent MITSUI TOATSU CHEMICALS, INC. (JP) 1994-04-12 US disclosed