SCHEMBL16672751

SCHEMBL16672751

CC(OCC(=O)OC(C)(C)C)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ CTSK P43235 3/20 0.41
▸ CTSS P25774 1/20 0.41
▸ HCAR2 Q8TDS4 1/20 0.41
▸ PTPN1 P18031 1/20 0.40
▸ FFAR1 O14842 1/20 0.39
▸ RIPK1 Q13546 2/20 0.39
▸ PTPRC P08575 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ KMT2A Q03164 1/20 0.37

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
SCHEMBL9292110 0.85 CTSS (0.42) L3MBTL1CTSKCTSSPTPN1RIPK1
SCHEMBL1904663 0.84 CYP19A1 (0.39) L3MBTL1LMNA
SCHEMBL16672470 0.81 ALDH1A1 (0.50) L3MBTL1HCAR2FFAR1MEN1KMT2A
SCHEMBL16713307 0.81 ALDH1A1 (0.39) L3MBTL1CTSKCTSSPTPN1PTPRC
SCHEMBL14578330 0.80 CTSS (0.39) L3MBTL1CTSKCTSSPTPN1RIPK1
SCHEMBL16672851 0.79 FFAR1 (0.49) L3MBTL1HCAR2FFAR1KMT2A
SCHEMBL16672677 0.79 CYP2D6 (0.49) MEN1LMNAKMT2A
SCHEMBL16672825 0.79 ATM (0.45) L3MBTL1HCAR2FFAR1
SCHEMBL6567073 0.77 TSHR (0.44) L3MBTL1HCAR2FFAR1MEN1KMT2A
SCHEMBL16672507 0.76 MAPT (0.43) L3MBTL1HCAR2FFAR1MEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2869389-B1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS ELECTROLYTIC SOLUTION CELL USING SAME MITSUBISHI CHEM CORP (JP) 2019-11-13 — — EP disclosed
US-10320030-B2 Nonaqueous electrolyte solution and nonaqueous electrolyte battery employing the same MITSUBISHI CHEMICAL CORPORATION (JP) 2019-06-11 — — US disclosed
US-20150140448-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY EMPLOYING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2015-05-21 — — US disclosed
EP-2869389-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS ELECTROLYTIC SOLUTION CELL USING SAME Mitsubishi Chemical Corporation (JP) 2015-05-06 — — EP disclosed
US-20140107135-A1 PYRIMIDINONE INHIBITORS OF LIPOPROTEIN-ASSOCIATED PHOSPHOLIPASE A2 AUSPEX PHARMACEUTICALS, INC. (US) 2014-04-17 — — 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-20140107135-A1 PYRIMIDINONE INHIBITORS OF LIPOPROTEIN-ASSOCIATED PHOSPHOLIPASE A2 PLA2G1B, PLA2G4A, PLA2G4B L3MBTL1 3877/4885CTSK 818/4885CTSS 1022/4885

“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.

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