Phenylacetic Acid

Phenylacetic Acid

SCHEMBL1835383

NCCO.O=C(O)Cc1ccccc1

nearest known ligand 0.74

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

MPL

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

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AKR1B1 P15121 1/20 0.74
▸ ABCC4 O15439 1/20 0.57
▸ LMNA P02545 1/20 0.57
▸ GAA P10253 1/20 0.57
▸ TSHR P16473 1/20 0.57
▸ PTGS1 P23219 1/20 0.57
▸ HTT P42858 1/20 0.57
▸ CES2 O00748 1/20 0.54
▸ CES1 P23141 1/20 0.54
▸ FFAR1 O14842 1/20 0.52
▸ CA2 P00918 1/20 0.50
▸ CAMK2A Q9UQM7 1/20 0.50
▸ HIF1A Q16665 1/20 0.48
▸ PAM P19021 2/20 0.47
▸ NAPRT Q6XQN6 1/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ HDAC8 Q9BY41 1/20 0.47
▸ HDAC6 Q9UBN7 1/20 0.47
▸ NSD2 O96028 1/20 0.46

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
Phenylacetic Acid SCHEMBL27486045 0.89 AKR1B1 (0.85) AKR1B1ABCC4LMNAGAATSHR
Phenylacetic Acid SCHEMBL10608383 0.87 AKR1B1 (0.74) AKR1B1ABCC4LMNAGAATSHR
Phenylacetic Acid SCHEMBL28668840 0.86 AKR1B1 (0.81) AKR1B1ABCC4LMNAGAATSHR
Phenylacetic Acid SCHEMBL7322793 0.86 AKR1B1 (0.90) AKR1B1ABCC4LMNAGAATSHR
Phenylacetic Acid SCHEMBL27758886 0.86 AKR1B1 (1.00) AKR1B1ABCC4LMNAGAATSHR
Phenylacetic Acid SCHEMBL28242469 0.86 AKR1B1 (1.00) AKR1B1ABCC4LMNAGAATSHR
Phenylacetic Acid SCHEMBL1330777 0.86 AKR1B1 (1.00) AKR1B1ABCC4LMNAGAATSHR
Phenylacetic Acid SCHEMBL9449909 0.86 AKR1B1 (1.00) AKR1B1ABCC4LMNAGAATSHR
Phenylacetic Acid SCHEMBL13618842 0.86 AKR1B1 (1.00) AKR1B1ABCC4LMNAGAATSHR
Phenylacetic Acid SCHEMBL1459 0.86 AKR1B1 (1.00) AKR1B1ABCC4LMNAGAATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112338091-B Punch forming process of aluminum alloy radiating fin 太仓巧洲五金科技有限公司 2022-08-02 — — CN claimed
CN-109180054-B Method for preparing gel reducing agent by sulfonated saccharide compounds 湖北工业大学 2021-06-18 — — CN claimed
CN-109133710-B Preparation method of naphthalene water reducer matching glue reducer 湖北工业大学 2021-06-18 — — CN claimed
CN-112851193-A Amphiphilic calcite type calcium carbonate-based gel reducing agent and preparation method thereof 深圳市天祥新材料有限公司 2021-05-28 — — CN claimed
CN-109437643-B Method for preparing gel reducing agent from amphoteric polyester polycarboxylic acid compound 湖北工业大学 2021-03-02 — — CN claimed
CN-109399990-B Preparation method of gel reducing agent for matching polycarboxylate superplasticizer 湖北工业大学 2021-03-02 — — CN claimed
CN-112338091-A Punch forming process of aluminum alloy radiating fin 太仓巧洲五金科技有限公司 2021-02-09 — — CN claimed
CN-109384881-B Method for preparing gel reducing agent from cationic polymer 湖北工业大学 2020-12-29 — — CN claimed
CN-112338091-B Punch forming process of aluminum alloy radiating fin 太仓巧洲五金科技有限公司 2022-08-02 — — CN disclosed
CN-109180054-B Method for preparing gel reducing agent by sulfonated saccharide compounds 湖北工业大学 2021-06-18 — — CN disclosed
CN-109133710-B Preparation method of naphthalene water reducer matching glue reducer 湖北工业大学 2021-06-18 — — CN disclosed
CN-112851193-A Amphiphilic calcite type calcium carbonate-based gel reducing agent and preparation method thereof 深圳市天祥新材料有限公司 2021-05-28 — — CN disclosed
CN-109399990-B Preparation method of gel reducing agent for matching polycarboxylate superplasticizer 湖北工业大学 2021-03-02 — — CN disclosed
CN-109437643-B Method for preparing gel reducing agent from amphoteric polyester polycarboxylic acid compound 湖北工业大学 2021-03-02 — — CN disclosed
US-8992798-B2 Liquids INNOVIA FILMS LIMITED (GB) 2015-03-31 — — US disclosed
US-8784686-B2 Liquids INNOVIA FILMS LIMITED (GB) 2014-07-22 — — US disclosed
US-20140187684-A1 LIQUIDS INNOVIA FILMS LIMITED (GB) 2014-07-03 — — US disclosed
US-20110257433-A1 LIQUIDS THE UNIVERSITY OF YORK (GB) 2011-10-20 — — US disclosed
EP-2322497-A1 Ionic liquids comprising nitrogen containing cations Innovia Films Limited (GB) 2011-05-18 — — EP disclosed
US-20070185330-A1 Liquids THE UNIVERSITY OF YORK (GB) 2007-08-09 — — US disclosed
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