Acetic Acid

Acetic Acid

SCHEMBL4317432

CC(=O)O.N#N

nearest known ligand 0.00

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Acetic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

⚠ 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
Acetic Acid SCHEMBL503684 0.94
Acetic Acid SCHEMBL5855458 0.89
Acetic Acid SCHEMBL29217338 0.89
Acetic Acid SCHEMBL7472549 0.88
Acetic Acid SCHEMBL1331719 0.88
Acetic Acid SCHEMBL1331810 0.88
Acetic Acid SCHEMBL1330415 0.88
Acetic Acid SCHEMBL8742314 0.88 FFAR3 (1.00)
Acetic Acid SCHEMBL1674512 0.88 FFAR3 (1.00)
Acetic Acid SCHEMBL6788 0.88 FFAR3 (1.00)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110194723-A A kind of N- Benzoylbenzene Isoserine derivatives and its synthetic method and application 华东师范大学 2019-09-03 CN claimed
CN-109776351-A A kind of diazonium acetate is continuously synthesizing to method 江苏优士化学有限公司 2019-05-21 CN claimed
CN-106146334-B 2,3- diaryl -2- alkynes propionamido- -3- arylamino methyl propionate derivative and its preparation method and application 华东师范大学 2019-01-18 CN claimed
CN-108285434-A The preparation method and application of three nitrogen piperazine -3,6- dicarboxylic acid esters of 5- aryl -1,2,4- 天津大学 2018-07-17 CN claimed
CN-108107120-A Using the method for Syrups by HPLC intermediate product 6,6- dibromo penicillanic acids 淄博鑫泉医药技术服务有限公司 2018-06-01 CN claimed
CN-104193645-B Preparation method of chiral dimethyl cyclopropyl carboxamide 上海应用技术学院 2017-02-01 CN claimed
CN-105884647-A Synthesis method of 3-hydroxyl diazoester intermediate alkyne compound 湖北科技学院 2016-08-24 CN claimed
CN-104177548-B A kind of fluorescence pyrazoline grafting polyvinyl alcohol and preparation method thereof 武汉大学 2016-08-24 CN claimed
CN-104403660-B One class bi-directional conversion luminescent material and preparation method thereof WUHAN UNIVERSITY (CN) 2016-05-25 CN claimed
CN-105566202-A 1,2,3,4-tetrahydro cyclopentyl indole derivative and synthesis method thereof UNIV EAST CHINA NORMAL 2016-05-11 CN claimed
CN-1061336-C 2,5-dimethyl-2,4 hexadiene and diazonium acetate cyclopropyl alkylation reaction and catalyst DALIAN CHEMICAL PHYSICS INST (CN) 2001-01-31 CN claimed
CN-1205326-A Process for producing opitically active cyclopropanecaboxylic acid esters SUMITOMO CHEMICAL CO (JP) 1999-01-20 CN claimed
CN-1191774-A Catalyst for cyclopropanization of 1,1-dichloro-4-methyl-1,3-pentylene DALIAN CHEMICAL PHYSICS INST (CN) 1998-09-02 CN claimed
CN-1191775-A High selectivity catalyst for synthesizing chrysanthemate contg. rich cis-chrysanthemate and its use DALIAN CHEMICAL PHYSICS INST (CN) 1998-09-02 CN claimed
CN-1191773-A Catalyst for cyclopropanization of 1,1-dichloro-4-methyl-1,3-pentylene and its application DALIAN CHEMICAL PHYSICS INST (CN) 1998-09-02 CN claimed
CN-1125220-A 2,5-dimethyl-2,4 hexadiene and diazonium acetate cyclopropyl alkylation reaction and catalyst DALIAN CHEMICAL PHYSICS INST (CN) 1996-06-26 CN claimed
CN-1114307-A Catalyst for cyclopropanization reaction of tetramethyl ethylene DALIAN CHEMICAL PHYSICS INST (CN) 1996-01-03 CN claimed
CN-1025495-C Preparation of 2, 2, 3, 3-tetramethyl cyclopropane carboxylic ester DALIAN CHEMICAL PHYSICS INST (CN) 1994-07-20 CN claimed
CN-1066057-A 2,2,3,3-4-methyl cyclopropane carboxylic acid ester's preparation DALIAN INST OF CHEMICO PHYSICS (CN) 1992-11-11 CN claimed
CN-1042713-A A kind of synthetic method of catalyzer UNIV BEIJING AGRICULT (CN) 1990-06-06 CN claimed