SCHEMBL16672825

SCHEMBL16672825

CC(OCC(=O)Oc1ccccc1)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ FFAR1 O14842 1/20 0.43
▸ CYP19A1 P11511 1/20 0.41
▸ HCAR2 Q8TDS4 1/20 0.41
▸ ELANE P08246 1/20 0.41
▸ PTGS1 P23219 1/20 0.41
▸ NPY5R Q15761 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ PRSS1 P07477 1/20 0.40
▸ PRSS2 P07478 1/20 0.40
▸ PRSS3 P35030 1/20 0.40
▸ NPC1 O15118 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ ESR1 P03372 1/20 0.39
▸ HIF1A Q16665 1/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ LTB4R Q15722 1/20 0.39
▸ LTB4R2 Q9NPC1 1/20 0.39

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
SCHEMBL9292224 0.83 ADRA1A (0.48) ATML3MBTL1ALDH1A1CYP19A1ELANE
SCHEMBL16672470 0.83 ALDH1A1 (0.50) L3MBTL1ALDH1A1FFAR1HCAR2
SCHEMBL16672576 0.81 ESR1 (0.44) ATML3MBTL1ALDH1A1FFAR1CYP19A1
SCHEMBL16672851 0.80 FFAR1 (0.49) L3MBTL1ALDH1A1FFAR1HCAR2ALOX15
SCHEMBL3438963 0.80 ELANE (0.45) ATML3MBTL1ALDH1A1CYP19A1ELANE
SCHEMBL16672677 0.80 CYP2D6 (0.49) ALDH1A1
SCHEMBL28238266 0.79 ELANE (0.51) ATML3MBTL1ALDH1A1CYP19A1ELANE
SCHEMBL17689273 0.79 ALDH1A1 (0.43) ALDH1A1CYP19A1ELANEGAAPRSS1
SCHEMBL16672751 0.79 L3MBTL1 (0.41) L3MBTL1FFAR1HCAR2
SCHEMBL9303071 0.78 ELANE (0.46) ATML3MBTL1ALDH1A1CYP19A1ELANE

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 4 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
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