Octanoic Acid

Octanoic Acid

SCHEMBL108744

CCCCCCCC(=O)[O-].C[N+](C)(C)C

nearest known ligand 0.82

Full drug profile on Sugi Atlas →

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FABP3 P05413 7/20 0.67
CA1 P00915 1/20 0.65
CES2 O00748 4/20 0.61
CES1 P23141 4/20 0.61
BBOX1 O75936 2/20 0.54

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
Decanoic Acid SCHEMBL107062 1.00 FABP3 (0.67) FABP3CA1CES2CES1BBOX1
Dodecanoate SCHEMBL5153809 1.00 FABP3 (0.67) FABP3CA1CES2CES1BBOX1
Heptanoate SCHEMBL108336 1.00 FABP3 (0.67) FABP3CA1CES2CES1BBOX1
Stearic Acid SCHEMBL109193 1.00 FABP3 (0.67) FABP3CA1CES2CES1BBOX1
Nonanoate SCHEMBL106670 1.00 FABP3 (0.67) FABP3CA1CES2CES1BBOX1
Heptadecanoic Acid SCHEMBL7549840 1.00 FABP3 (0.67) FABP3CA1CES2CES1BBOX1
Palmitic Acid SCHEMBL5155811 1.00 FABP3 (0.67) FABP3CA1CES2CES1BBOX1
Myristic Acid SCHEMBL5154017 1.00 FABP3 (0.67) FABP3CA1CES2CES1BBOX1
Octanoic Acid SCHEMBL28057625 0.98 FABP3 (0.64) FABP3CA1CES2CES1BBOX1
Hexanoate SCHEMBL105666 0.98 CA1 (0.68) FABP3CA1CES2CES1BBOX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117996204-A Manufacturing method of in-situ curing electrolyte battery and battery 北京卫蓝新能源科技有限公司 2024-05-07 CN claimed
CN-111788244-B rigid foam 伊科尼克技术有限公司 2023-09-15 CN claimed
US-20230272151-A1 STORAGE-STABLE POLYISOCYANATE COMPOSITION AND PREPARATION METHOD THEREFOR WANHUA CHEMICAL GROUP CO., LTD. (CN) 2023-08-31 US claimed
EP-4159781-A1 STORAGE-STABLE POLYISOCYANATE COMPOSITION AND PREPARATION METHOD THEREFOR Wanhua Chemical Group Co., Ltd (CN) 2023-04-05 EP claimed
CN-115286588-A Process for preparing pentamethylene isocyanurate 中海油常州涂料化工研究院有限公司 2022-11-04 CN claimed
CN-115084647-A Preparation method of solid electrolyte prepared by in-situ self-polymerization of isocyanate and application of solid electrolyte in-situ solid battery 北京卫蓝新能源科技有限公司 2022-09-20 CN claimed
WO-2022061704-A1 STORAGE-STABLE POLYISOCYANATE COMPOSITION AND PREPARATION METHOD THEREFOR 万华化学集团股份有限公司 2022-03-31 WO claimed
CN-114249868-A Polyisocyanate composition with stable storage and preparation method thereof 万华化学集团股份有限公司 2022-03-29 CN claimed
CN-113234034-A Preparation method of m-xylylene diisocyanate trimer 江苏快达农化股份有限公司 2021-08-10 CN claimed
CN-110183390-B Preparation method of bio-based pentamethylene diisocyanate trimer 中海油常州涂料化工研究院有限公司 2021-01-19 CN claimed
CN-111788244-A Rigid foam 艾柯尼克技术有限公司 2020-10-16 CN claimed
US-3989651-A TRIMERIZATION, N,N-DIMETHYLCYCLOHEXYLAMINE, TETRA-ALKYL AMMONIUM ALKANOIC ACID SALT THE UPJOHN COMPANY (US) 1976-11-02 US claimed
US-3954684-A QUATERNARY AMMONIUM SALT CATALYSTTRIMERIZATION OF POLYISOCYANATE THE UPJOHN COMPANY (US) 1976-05-04 US claimed
EP-4653481-A1 POLYISOCYANATE COMPOSITION, MIXTURE, COATING COMPOSITION, AND COATING FILM Asahi Kasei Kabushiki Kaisha (JP) 2025-11-26 EP disclosed
US-12410277-B2 Block polyisocyanate composition, resin composition, resin film and layered body ASAHI KASEI KABUSHIKI KAISHA (JP) 2025-09-09 US disclosed
WO-2025079717-A1 POLYESTER FILM HAVING RESIN THIN FILM LAYER 東洋紡株式会社 2025-04-17 WO disclosed
US-4503226-A QUATERNARY AMMONIUM CARBOXYLATE CATALYST OLIN CORPORATION (US) 1985-03-05 US disclosed
US-3989651-A TRIMERIZATION, N,N-DIMETHYLCYCLOHEXYLAMINE, TETRA-ALKYL AMMONIUM ALKANOIC ACID SALT THE UPJOHN COMPANY (US) 1976-11-02 US disclosed
US-3980594-A Trimerization of aromatic isocyanates catalyzed by certain ammonium salts THE GENERAL TIRE & RUBBER COMPANY (US) 1976-09-14 US disclosed
US-3954684-A QUATERNARY AMMONIUM SALT CATALYSTTRIMERIZATION OF POLYISOCYANATE THE UPJOHN COMPANY (US) 1976-05-04 US disclosed