SCHEMBL2116492

SCHEMBL2116492

CCC(CC)(CCCC(=O)OC)C(=O)OC

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.52
CYP4F2 P78329 1/20 0.44
CYP4A11 Q02928 1/20 0.44
PTPRB P23467 1/20 0.42
LMNA P02545 3/20 0.39
ALDH1A1 P00352 1/20 0.39
RECQL P46063 1/20 0.38
CA12 O43570 3/20 0.38
CA14 Q9ULX7 3/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
EPHX2 P34913 1/20 0.37
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
KDM4E B2RXH2 1/20 0.34
GLA P06280 1/20 0.34

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
SCHEMBL14890680 0.93 TSHR (0.48) TSHRCYP4F2CYP4A11PTPRBLMNA
SCHEMBL28625986 0.88 TSHR (0.48) TSHRCYP4F2CYP4A11PTPRBLMNA
SCHEMBL11215497 0.82 CYP4F2 (0.46) TSHRCYP4F2CYP4A11
SCHEMBL28936386 0.82 CYP4F2 (0.48) CYP4F2CYP4A11LMNAALDH1A1CA12
SCHEMBL7438044 0.80 CYP4F2 (0.67) CYP4F2CYP4A11LMNAALDH1A1MEN1
SCHEMBL20002145 0.79 TSHR (0.43) TSHRCYP4F2CYP4A11LMNAALDH1A1
SCHEMBL9620419 0.78 TSHR (0.54) TSHRPTPRBLMNAALDH1A1RECQL
SCHEMBL9245427 0.78 CYP4F2 (0.50) CYP4F2CYP4A11LMNAMEN1KMT2A
SCHEMBL7438928 0.78 CYP4F2 (0.46) CYP4F2CYP4A11LMNAKDM4E
SCHEMBL17617116 0.77 CYP4F2 (0.42) TSHRCYP4F2CYP4A11LMNAALDH1A1

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-20120090846-A1 MODIFICATION OF SOLID POLYSACCHARIDE WITH TRANSESTERIFICATION AGENT HALLIBURTON ENERGY SERVICES, INC. (US) 2012-04-19 US disclosed
US-20120090848-A1 MODIFICATION OF SOLID POLYSACCHARIDE WITH TRANSESTERIFICATION AGENT HALLIBURTON ENERGY SERVICES, INC. 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 TSHR 3439/4885CYP4F2 3581/4885CYP4A11 1602/4885

“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.