SCHEMBL2097450

SCHEMBL2097450

COC(=O)C(C)(C(=O)O)C(=O)OC

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.44
TSHR P16473 3/20 0.40
ALDH1A1 P00352 2/20 0.40
KCNN4 O15554 1/20 0.39
SRC P12931 1/20 0.35
ELANE P08246 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32
HIF1A Q16665 1/20 0.32
MAPT P10636 1/20 0.31
HCAR2 Q8TDS4 2/20 0.31
KEAP1 Q14145 1/20 0.30
NFE2L2 Q16236 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
SCHEMBL2097284 0.84 PKM (0.41) TSHRALDH1A1MAPT
SCHEMBL15829477 0.81 TSHR (0.35) DGAT1TSHRALDH1A1
Pivalate SCHEMBL29716693 0.77 DGAT1 (0.44) DGAT1TSHRALDH1A1KCNN4SRC
SCHEMBL1661824 0.77 DGAT1 (0.44) DGAT1TSHRALDH1A1KCNN4SRC
SCHEMBL1010735 0.77 DGAT1 (0.56) DGAT1TSHRALDH1A1KCNN4SRC
SCHEMBL1425286 0.74 DGAT1 (0.42) DGAT1TSHRALDH1A1KCNN4SRC
Hydrochloric Acid SCHEMBL10829675 0.74 DGAT1 (0.54) DGAT1TSHRALDH1A1KCNN4SRC
SCHEMBL4070809 0.74 ALDH1A1 (0.45) DGAT1TSHRALDH1A1KCNN4SRC
SCHEMBL28803702 0.74 DGAT1 (0.54) DGAT1TSHRALDH1A1KCNN4SRC
SCHEMBL30440750 0.74 DGAT1 (0.54) DGAT1TSHRALDH1A1KCNN4SRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8372300-B2 Additives for electrolyte solution and electrolyte solution OTSUKA CHEMICAL CO., LTD. (JP) 2013-02-12 US claimed
EP-2037468-B1 ADDITIVE FOR ELECTROLYTE SOLUTION AND ELECTROLYTE SOLUTION OTSUKA CHEMICAL CO LTD (JP) 2012-10-24 EP claimed
US-20120170172-A1 ADDITIVES FOR ELECTROLYTE SOLUTION AND ELECTROLYTE SOLUTION OKA AKINORI (JP) 2012-07-05 US claimed
US-8163195-B2 Additives for electrolyte solution and electrolyte solution OTSUKA CHEMICAL CO., LTD. (JP) 2012-04-24 US claimed
US-20090309060-A1 Additives for Electrolyte Solution and Electrolyte Solution OTSUKA CHEMICAL CO., LTD. (JP) 2009-12-17 US claimed
CN-101479818-A Additive for electrolyte and electrolyte OTSUKA CHEMICAL CO LTD (JP) 2009-07-08 CN claimed
EP-2037468-A1 ADDITIVE FOR ELECTROLYTE SOLUTION AND ELECTROLYTE SOLUTION Otsuka Chemical Co., Ltd. (JP) 2009-03-18 EP claimed
CN-116457399-A Adhesion of particles containing foaming agent based on polyimide or polyacrylate 赢创运营有限公司 2023-07-18 CN disclosed
EP-1806342-B1 3-CARBAMOYL-2-PYRIDONE DERIVATIVE SHIONOGI & CO (JP) 2013-04-17 EP disclosed
US-8372300-B2 Additives for electrolyte solution and electrolyte solution OTSUKA CHEMICAL CO., LTD. (JP) 2013-02-12 US disclosed
US-8367666-B2 3-carbamoyl-2-pyridone derivatives SHIONOGI & CO., LTD. (JP) 2013-02-05 US disclosed
EP-2037468-B1 ADDITIVE FOR ELECTROLYTE SOLUTION AND ELECTROLYTE SOLUTION OTSUKA CHEMICAL CO LTD (JP) 2012-10-24 EP disclosed
CN-101479818-B Additive for electrolyte and electrolyte OTSUKA CHEMICAL CO LTD 2012-10-17 CN disclosed
US-8178681-B2 methyl 3-methyl-2-{[2-oxo-1-(2-oxo-ethyl)-1,2,5,6,7,8,9,10-octahydro-cycloocta[b]pyridine-3-carbonyl]-amino}-butyrate; cannabinoid receptor agonist; antiinflammatory agent, immunostimulant, analgesic; atopic dermatitis; excellent in photostability, and have excellent transdermal and oral absorbency SHIONOGI & CO., LTD. (JP) 2012-05-15 US disclosed
US-8163195-B2 Additives for electrolyte solution and electrolyte solution OTSUKA CHEMICAL CO., LTD. (JP) 2012-04-24 US disclosed
US-20090309060-A1 Additives for Electrolyte Solution and Electrolyte Solution OTSUKA CHEMICAL CO., LTD. (JP) 2009-12-17 US disclosed
CN-101479818-A Additive for electrolyte and electrolyte OTSUKA CHEMICAL CO LTD (JP) 2009-07-08 CN disclosed
EP-2037468-A1 ADDITIVE FOR ELECTROLYTE SOLUTION AND ELECTROLYTE SOLUTION Otsuka Chemical Co., Ltd. (JP) 2009-03-18 EP disclosed
US-20080103139-A1 3-Carbamoyl-2-Pyridone Derivative SHIONOGI & CO. LTD. (JP) 2008-05-01 US disclosed
EP-1806342-A1 3-CARBAMOYL-2-PYRIDONE DERIVATIVE SHIONOGI & CO., LTD. (JP) 2007-07-11 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080103139-A1 3-Carbamoyl-2-Pyridone Derivative CNR1, CNR2, HRH4 DGAT1 2352/4885TSHR 1109/4885ALDH1A1 4132/4885
US-20090309060-A1 Additives for Electrolyte Solution and Electrolyte Solution SLC9A1, SLC26A3, AQP1 DGAT1 2888/4885TSHR 4478/4885ALDH1A1 342/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.