SCHEMBL322477

SCHEMBL322477

CC(C)(C(=O)O)C(=O)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.53
ALDH1A1 P00352 2/20 0.53
CYP2D6 P10635 1/20 0.35
CYP2C19 P33261 1/20 0.35
HIF1A Q16665 1/20 0.35
TET2 Q6N021 1/20 0.33
TP53 P04637 1/20 0.32
HMGCR P04035 1/20 0.30
CHRM1 P11229 1/20 0.30
TBXA2R P21731 1/20 0.30
ADRA1A P35348 1/20 0.30
CYP2C9 P11712 1/20 0.30

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
SCHEMBL10715110 0.84 TSHR (0.42) TSHRALDH1A1CYP2D6CYP2C19HIF1A
SCHEMBL8069769 0.80 ALDH1A1 (0.44) TSHRALDH1A1HMGCRCHRM1TBXA2R
SCHEMBL52160 0.78
SCHEMBL11587164 0.74 TSHR (0.53) TSHRALDH1A1CYP2D6CYP2C19HIF1A
Hydrochloric Acid SCHEMBL4682921 0.74 TSHR (0.53) TSHRALDH1A1CYP2D6CYP2C19HIF1A
SCHEMBL107651 0.74 TSHR (0.53) TSHRALDH1A1CYP2D6CYP2C19HIF1A
SCHEMBL5685806 0.74
Hydrochloric Acid SCHEMBL808934 0.74 TSHR (0.53) TSHRALDH1A1CYP2D6CYP2C19HIF1A
SCHEMBL106724 0.74 TSHR (0.53) TSHRALDH1A1CYP2D6CYP2C19HIF1A
SCHEMBL105855 0.74 TSHR (0.53) TSHRALDH1A1CYP2D6CYP2C19HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118662680-A Dimethyl oxaloacetate-loaded composite dressing as well as preparation method and application thereof 天津师范大学 2024-09-20 CN claimed
CN-116905058-A Preparation method of titanium-based inert anode 中南大学 2023-10-20 CN claimed
CN-104710817-B The small-molecular-weight Coumarins near infrared fluorescent dye and its synthetic method of a kind of big Stokes shift 中国科学院大连化学物理研究所 2017-09-22 CN claimed
EP-1570032-B1 Water blended fuel composition LUBRIZOL CORP (US) 2011-02-09 EP claimed
CN-1745163-B Water blended fuel composition LUBRIZOL CORP 2010-12-08 CN claimed
US-7722688-B2 Fuel composition having a normally liquid hydrocarbon fuel, water, a high molecular weight emulsifier, and a nitrogen-free surfactant including a hydrocarbyl substituted carboxylic acid or a reaction product of the hydrocarbyl substituted carboxylic acid or reactive equivalent of such acid with an alcohol THE LUBRIZOL CORPORATION (US) 2010-05-25 US claimed
US-20060162240-A1 Fuel composition having a normally liquid hydrocarbon fuel, water, a high molecular weight emulsifier, and a nitrogen-free surfactant including a hydrocarbyl substituted carboxylic acid or a reaction product of the hydrocarbyl substituted carboxylic acid or reactive equivalent of such acid with an alcohol FILIPPINI BRIAN B 2006-07-27 US claimed
CN-1745163-A Water blended fuel composition LUBRIZOL CORP (US) 2006-03-08 CN claimed
EP-1570032-A1 WATER BLENDED FUEL COMPOSITION THE LUBRIZOL CORPORATION (US) 2005-09-07 EP claimed
WO-2004055138-A1 WATER BLENDED FUEL COMPOSITION THE LUBRIZOL CORPORATION (US) 2004-07-01 WO claimed
US-20040111957-A1 Water blended fuel composition LUBRIZOL CORPORATION, THE 2004-06-17 US claimed
CN-120346382-A Biphase hydrogel system based on space-time gradient regulation and control and preparation method and application thereof 上海大学 2025-07-22 CN disclosed
CN-119548513-A Application of araloside A in preparation of medicine for treating sepsis and lung injury 温州医科大学附属第一医院 2025-03-04 CN disclosed
CN-118662680-A Dimethyl oxaloacetate-loaded composite dressing as well as preparation method and application thereof 天津师范大学 2024-09-20 CN disclosed
CN-118662680-A Dimethyl oxaloacetate-loaded composite dressing as well as preparation method and application thereof 天津师范大学 2024-09-20 CN disclosed
US-4656283-A HERBICIDAL INTERMEDIATES AMERICAN CYANAMID COMPANY (US) 1987-04-07 US disclosed
EP-0029719-B1 VULCANIZABLE RUBBER COMPOSITIONS INHIBITED FROM PREMATURE VULCANIZATION BY METHYLENE THIOETHERS, AND NOVEL METHYLENE THIOETHERS MONSANTO COMPANY (US) 1983-02-16 EP disclosed
US-4342705-A CONTAINING CARBONYL OR CYANO FUNCTIONAL GROUPS, USEFUL AS VULCANIZATION INHIBITORS MONSANTO COMPANY (US) 1982-08-03 US disclosed
EP-0029719-A1 Vulcanizable rubber compositions inhibited from premature vulcanization by methylene thioethers, and novel methylene thioethers MONSANTO COMPANY (US) 1981-06-03 EP disclosed
US-4271050-A Vulcanizable rubber compositions inhibited from premature vulcanization by methylene thioethers MONSANTO COMPANY (US) 1981-06-02 US disclosed