SCHEMBL6155938

SCHEMBL6155938

CC(=O)OC(C)(C#N)C#N

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.41
CTSK P43235 3/20 0.33
TDP1 Q9NUW8 2/20 0.32
HSD17B10 Q99714 1/20 0.32
LMNA P02545 1/20 0.32
ALDH1A1 P00352 2/20 0.32
TSHR P16473 1/20 0.32
DGAT1 O75907 1/20 0.31
CTSS P25774 2/20 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
SCHEMBL2343523 0.81 CTSK (0.34) CTSKDGAT1CTSS
Acetonitrile SCHEMBL28018562 0.79 GAA (0.41) GAACTSKLMNAALDH1A1TSHR
SCHEMBL2343527 0.79 CTSK (0.33) CTSKALDH1A1TSHRDGAT1CTSS
SCHEMBL585284 0.79
Water SCHEMBL27601078 0.77
SCHEMBL4052286 0.77 CTSK (0.32) CTSKHSD17B10LMNADGAT1
SCHEMBL18672365 0.76 GAA (0.37) GAATDP1HSD17B10LMNAALDH1A1
SCHEMBL7699870 0.75 GAA (0.38) GAAALDH1A1
SCHEMBL22321689 0.75 GAA (0.38) GAA
SCHEMBL7699871 0.75 GAA (0.38) GAAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240170733-A1 NON-AQUEOUS ELECTROLYTIC SOLUTION SECONDARY BATTERY AND METHOD FOR PRODUCING NON-AQUEOUS ELECTROLYTIC SOLUTION SECONDARY BATTERY Panasonic Energy Co., Ltd. (JP) 2024-05-23 US disclosed
US-11652237-B2 Nonaqueous electrolyte solution including boron compound additive having higher reductive decomposition potential than additional additive and lithium secondary battery including the same MITSUI CHEMICALS, INC. (JP) 2023-05-16 US disclosed
WO-2022202779-A1 NON-AQUEOUS ELECTROLYTIC SOLUTION SECONDARY BATTERY AND METHOD FOR PRODUCING NON-AQUEOUS ELECTROLYTIC SOLUTION SECONDARY BATTERY 三洋電機株式会社 2022-09-29 WO disclosed
US-20210126288-A1 NONAQUEOUS ELECTROLYTE SOLUTION FOR BATTERY AND LITHIUM SECONDARY BATTERY MITSUI CHEMICALS, INC. (JP) 2021-04-29 US disclosed
EP-3675268-A1 LITHIUM SECONDARY BATTERY AND NONAQUEOUS ELECTROLYTE SOLUTION Mitsui Chemicals, Inc. (JP) 2020-07-01 EP disclosed
EP-3675267-A1 NONAQUEOUS ELECTROLYTE SOLUTION FOR BATTERIES, AND LITHIUM SECONDARY BATTERY Mitsui Chemicals, Inc. (JP) 2020-07-01 EP disclosed
US-20200203768-A1 LITHIUM SECONDARY BATTERY AND NONAQUEOUS ELECTROLYTE SOLUTION MITSUI CHEMICALS, INC. (JP) 2020-06-25 US disclosed
US-20170346127-A1 LITHIUM SECONDARY BATTERY MITSUI CHEMICALS, INC. (JP) 2017-11-30 US disclosed
EP-3211706-A1 LITHIUM SECONDARY BATTERY Mitsui Chemicals, Inc. (JP) 2017-08-30 EP disclosed
EP-1090930-B1 POLYMERIZATION METHOD KANEKA CORP (JP) 2005-05-04 EP disclosed
US-4812592-A Process for the preparation of the esters of an acid ISTITUTO GUIDO DONEGANI, S.P.A. (IT) 1989-03-14 US disclosed
US-4701550-A Process for preparing alkyl esters of methyltartronic acid ISTITUTO GUIDO DONEGANI S.P.A. (IT) 1987-10-20 US disclosed
EP-0230916-A1 Process for the preparation of the esters of an alkyltartronic acid ISTITUTO GUIDO DONEGANI S.p.A. (IT) 1987-08-05 EP disclosed
EP-0166348-A2 Process for preparing alkyl esters of methyltartronic acid ISTITUTO GUIDO DONEGANI S.p.A. (IT) 1986-01-02 EP disclosed
US-4501916-A REACTION OF LOWER ALCOHOL WITH OPTIONALLY HALOGEN-SUBSTITUTED 1-HYDROXY-1,1-DICYANO-ALKANE MONTEDISON S.P.A. (IT) 1985-02-26 US disclosed
EP-0056264-B1 PROCESS FOR PREPARING ALKYL ESTERS OF C-ALKYL-TARTRONIC OR C-HALOGENALKYL-TARTRONIC ACIDS Montedison S.p.A. (IT) 1984-07-25 EP disclosed
EP-0093338-A1 Method for the preparation of cyanohydrine-carboxylic-acid esters BAYER AG (DE) 1983-11-09 EP disclosed
EP-0056264-A1 Process for preparing alkyl esters of C-alkyl-tartronic or C-halogenalkyl-tartronic acids Montedison S.p.A. (IT) 1982-07-21 EP disclosed
US-4159991-A Acyloxy-N,N'-diacylmalonamides and methods for their preparation PRODUITS CHIMIQUES UGINE KUHLMANN (FR) 1979-07-03 US disclosed
US-4006178-A Process for the manufacture of dicyanovinyl compounds CIBA-GEIGY CORPORATION (US) 1977-02-01 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-20170346127-A1 LITHIUM SECONDARY BATTERY SLC9B2, SCN11A, NUCB2 GAA 1107/4885CTSK 2315/4885TDP1 2427/4885

“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.