SCHEMBL305795

SCHEMBL305795

COC(=O)OCC(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.37
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
CYP2C19 P33261 1/20 0.35
ALDH1A1 P00352 2/20 0.33
TSHR P16473 2/20 0.33
HSD17B10 Q99714 2/20 0.31
LMNA P02545 1/20 0.31
HTT P42858 1/20 0.31
DGAT1 O75907 1/20 0.31
MGAM O43451 2/20 0.31
GAA P10253 2/20 0.31
SI P14410 2/20 0.31
MGAM2 Q2M2H8 2/20 0.31
GRIN2D O15399 1/20 0.31
GRIN3B O60391 1/20 0.31
GRIN1 Q05586 1/20 0.31
GRIN2A Q12879 1/20 0.31
GRIN2B Q13224 1/20 0.31

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
SCHEMBL320682 0.86 ALDH1A1 (0.45) KMT2ACYP2C19ALDH1A1HSD17B10LMNA
SCHEMBL17231843 0.84 LMNA (0.40) CA1CA2SMN1; SMN2ALDH1A1TSHR
SCHEMBL9443410 0.81 MAPK1 (0.37) CA1CA2SMN1; SMN2ALDH1A1TSHR
SCHEMBL632730 0.81 CYP2C19 (0.36) KMT2ACYP2C19ALDH1A1HSD17B10LMNA
SCHEMBL9790004 0.81 SOAT1 (0.50) KMT2ACYP2C19ALDH1A1HSD17B10LMNA
SCHEMBL17050361 0.80 CA1 (0.33) CA1CA2SMN1; SMN2ALDH1A1TSHR
SCHEMBL15085753 0.80 HTT (0.38) CA1CA2SMN1; SMN2ALDH1A1TSHR
SCHEMBL13909023 0.78 KMT2A (0.34) KMT2ACYP2C19
SCHEMBL29310395 0.78 KMT2A (0.34) KMT2ACYP2C19
SCHEMBL14351453 0.78 DGAT1 (0.37) CA1CA2SMN1; SMN2DGAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7687490-B2 2-thioethenyl substituted carbapenem derivatives MEIJI SEIKA KAISHA, LTD. (JP) 2010-03-30 US claimed
EP-1870412-A1 2-THIOETHENYL CARBAPENEM DERIVATIVE MEIJI SEIKA KAISHA LTD. (JP) 2007-12-26 EP claimed
US-20070004700-A1 2-Thioethenyl substituted carbapenem derivatives MEIJI SEIKA KAISHA, LTD. (JP) 2007-01-04 US claimed
EP-1083247-B9 Use of organic carbonates as solvents for the washing of metal surfaces POLIMERI EUROPA SPA (IT) 2006-03-22 EP claimed
EP-1083247-B1 Use of organic carbonates as solvents for the washing of metal surfaces POLIMERI EUROPA SPA (IT) 2005-11-16 EP claimed
US-6818049-B1 HALOGEN FREE INDUSTRIAL SOLVENT FORMULATION; LOW REACTIVITY TO OZONE FORMATION EXXONMOBIL CHEMICAL PATENTS INC. 2004-11-16 US claimed
US-6506243-B1 Industrial solvents; dialkyl carbonates, alkyl acetates, dioxolanes, pivalates, isobutyrates, nitriles EXXONMOBIL CHEMICAL PATENTS INC. 2003-01-14 US claimed
WO-2002064687-A1 ENVIRONMENTALLY PREFERRED FLUIDS AND FLUID BLENDS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2002-08-22 WO claimed
EP-1090085-A1 ENVIRONMENTALLY PREFERRED FLUIDS AND FLUID BLENDS EXXON CHEMICAL PATENTS INC. (US) 2001-04-11 EP claimed
WO-1999057217-A1 ENVIRONMENTALLY PREFERRED FLUIDS AND FLUID BLENDS EXXON CHEMICAL PATENTS INC. (US) 1999-11-11 WO claimed
US-5659062-A CARBONATE COMPOUNDS MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1997-08-19 US claimed
CN-118900839-A Antiviral compounds and methods of making and using the same 吉利德科学公司 2024-11-05 CN disclosed
CN-113164506-B Dinucleotide compounds and prodrugs thereof 正大天晴药业集团股份有限公司 2023-12-08 CN disclosed
US-20230322793-A1 10-(di(phenyl)methyl)-4-hydroxy-8,9,9A,10-tetrahydro-7H-pyrrolo[1 ',2':4,5]pyrazino[1,2-B]pyridazine-3,5-dione Derivatives and Related Compounds as Inhibitors of the Orthomyxovirus Replication for Treating Influenza NOVARTIS AG (CH) 2023-10-12 US disclosed
CN-116437930-A Use of uridine derivatives in the preparation of medicaments 上海岸阔医药科技有限公司 2023-07-14 CN disclosed
US-5633099-A Carbonate compounds, non-aqueous electrolytic solutions and batteries comprising non-aqueous electrolytic solutions MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1997-05-27 US disclosed
EP-0599534-B1 Novel carbonate compounds, non-aqueous electrolytic solutions and batteries comprising nonaqueous electrolytic solutions MITSUI PETROCHEMICAL IND (JP) 1997-04-16 EP disclosed
EP-0721454-A1 NEW PYRAZOLE DERIVATIVES AS ANGIOTENSIN II ANTAGONIST J. URIACH & CIA. S.A. (ES) 1996-07-17 EP disclosed
WO-1996004273-A1 NEW PYRAZOLE DERIVATIVES AS ANGIOTENSIN II ANTAGONIST J. URIACH & CIA, S.A. (ES) 1996-02-15 WO disclosed
EP-0599534-A1 Novel carbonate compounds, non-aqueous electrolytic solutions and batteries comprising nonaqueous electrolytic solutions MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1994-06-01 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-20070004700-A1 2-Thioethenyl substituted carbapenem derivatives MTAP, BLVRB, BPGM KMT2A 351/4885CA1 3160/4885CA2 1641/4885
US-20230322793-A1 10-(di(phenyl)methyl)-4-hydroxy-8,9,9A,10-tetrahydro-7H-pyrrolo[1 ',2':4,5]pyrazino[1,2-B]pyridazine-3,5-dione Derivatives and Related Compounds as Inhibitors of the Orthomyxovirus Replication for Treating Influenza MAVS, ZC3HAV1, EIF2AK2 KMT2A 1290/4885CA1 4814/4885CA2 4297/4885

“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.