SCHEMBL2116494

SCHEMBL2116494

CCOC(=O)CCCC(C)(C)C(=O)OCC

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 3/20 0.62
CYP4A11 Q02928 3/20 0.62
CYP1A2 P05177 1/20 0.52
NR1I2 O75469 1/20 0.42
PGR P06401 1/20 0.42
ADORA3 P0DMS8 1/20 0.42
PTGS2 P35354 1/20 0.42
PDE4D Q08499 1/20 0.42
GAA P10253 2/20 0.42
MGAM O43451 1/20 0.41
SI P14410 1/20 0.41
MGAM2 Q2M2H8 1/20 0.41
THRB P10828 1/20 0.41
PKM P14618 1/20 0.41
ALDH1A1 P00352 2/20 0.40
CYP3A4 P08684 1/20 0.40
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40
HSD17B10 Q99714 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL14890704 0.93 CYP4F2 (0.69) CYP4F2CYP4A11CYP1A2NR1I2PGR
SCHEMBL14809522 0.93 CYP4F2 (0.69) CYP4F2CYP4A11CYP1A2NR1I2PGR
SCHEMBL4577570 0.88 CYP4F2 (0.56) CYP4F2CYP4A11CYP1A2NR1I2PGR
SCHEMBL4100780 0.85 CYP4F2 (0.62) CYP4F2CYP4A11THRBPKMALDH1A1
SCHEMBL6257314 0.84 CYP4F2 (0.85) CYP4F2CYP4A11GAAMGAMSI
SCHEMBL6254544 0.84 CYP4F2 (0.85) CYP4F2CYP4A11GAAMGAMSI
SCHEMBL1661139 0.82 CYP4F2 (0.65) CYP4F2CYP4A11CYP1A2GAAMGAM
SCHEMBL8165697 0.82 CYP1A2 (0.57) CYP4F2CYP4A11CYP1A2NR1I2PGR
SCHEMBL7941258 0.82 CYP4F2 (0.69) CYP4F2CYP4A11CYP1A2THRBPKM
SCHEMBL186726 0.82 CYP4F2 (0.55) CYP4F2CYP4A11CYP1A2NR1I2PGR

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3252861-B1 NON-AQUEOUS ELECTROLYTE SOLUTION, AND NON-AQUEOUS-ELECTROLYTE SECONDARY CELL USING SAME MITSUBISHI CHEM CORP (JP) 2019-06-26 EP disclosed
WO-2019110355-A1 BRANCHED ADIPIC ACID BASED ESTERS AS NOVEL BASE STOCKS AND LUBRICANTS BASF SE (DE) 2019-06-13 WO disclosed
EP-3252861-A1 NON-AQUEOUS ELECTROLYTE SOLUTION, AND NON-AQUEOUS-ELECTROLYTE SECONDARY CELL USING SAME Mitsubishi Chemical Corporation (JP) 2017-12-06 EP disclosed
US-20170324116-A1 NON-AQUEOUS ELECTROLYTE SOLUTION AND NON-AQUEOUS ELECTROLYTE SOLUTION SECONDARY BATTERY USING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2017-11-09 US disclosed
EP-2909285-A1 GELLING AGENTS AND METHODS OF USING THE SAME Halliburton Energy Services, Inc. (US) 2015-08-26 EP disclosed
WO-2014062493-A1 GELLING AGENTS AND METHODS OF USING THE SAME HALLIBURTON ENERGY SERVICES, INC. (US) 2014-04-24 WO disclosed
US-20140110115-A1 Gelling Agents and Methods of Using the Same HALLIBURTON ENERGY SERVICES, INC. (US) 2014-04-24 US disclosed
EP-2502971-A1 Modification of Solid Polysaccharide with Transesterification Agent Halliburton Energy Service, Inc. (US) 2012-09-26 EP disclosed
WO-2012052716-A1 MODIFICATION OF SOLID POLYSACCHARIDE WITH TRANSESTERIFICATION AGENT HALLIBURTON ENERGY SERVICES, INC. (US) 2012-04-26 WO disclosed
US-20120090848-A1 MODIFICATION OF SOLID POLYSACCHARIDE WITH TRANSESTERIFICATION AGENT HALLIBURTON ENERGY SERVICES, INC. 2012-04-19 US disclosed
US-20120090846-A1 MODIFICATION OF SOLID POLYSACCHARIDE WITH TRANSESTERIFICATION AGENT HALLIBURTON ENERGY SERVICES, INC. (US) 2012-04-19 US 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 (1 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-20170324116-A1 NON-AQUEOUS ELECTROLYTE SOLUTION AND NON-AQUEOUS ELECTROLYTE SOLUTION SECONDARY BATTERY USING THE SAME KCNN2, KCNE1, KCNN1 CYP4F2 3581/4885CYP4A11 1602/4885CYP1A2 3596/4885

“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.