SCHEMBL14775426

SCHEMBL14775426

CCC#Cc1ccccc1OC(=O)Oc1ccccc1C#CCC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 6/20 0.43
PTGDR2 Q9Y5Y4 2/20 0.39
KDM4E B2RXH2 4/20 0.38
HSD17B10 Q99714 3/20 0.38
HPGD P15428 1/20 0.38
FFAR1 O14842 1/20 0.38
GLA P06280 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
CYP1A2 P05177 2/20 0.35
ALDH1A1 P00352 1/20 0.35
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
LMNA P02545 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
MAPT P10636 1/20 0.33
CYP2C9 P11712 1/20 0.33
APEX1 P27695 1/20 0.33
CYP2C19 P33261 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL14775430 0.88 PTGS2 (0.42) PTGS2PTGDR2KDM4EHSD17B10HPGD
SCHEMBL3699125 0.80 HPGD (0.41) PTGS2PTGDR2KDM4EHSD17B10HPGD
SCHEMBL28646255 0.80 POLB (0.38) PTGS2PTGDR2KDM4EHSD17B10FFAR1
SCHEMBL28352745 0.78 CA1 (0.46) PTGDR2FFAR1L3MBTL1CYP1A2ALDH1A1
SCHEMBL12134768 0.75 ALDH1A1 (0.40) PTGDR2KDM4EHSD17B10L3MBTL1CYP1A2
SCHEMBL12134446 0.74 CYP1A2 (0.44) PTGDR2KDM4EL3MBTL1CYP1A2ALDH1A1
SCHEMBL12092014 0.72 CYP1A2 (0.33) PTGS2PTGDR2KDM4EFFAR1CYP1A2
SCHEMBL12092011 0.72 CYP1A2 (0.33) PTGS2PTGDR2KDM4EFFAR1CYP1A2
SCHEMBL12092017 0.72 CYP1A2 (0.33) PTGS2PTGDR2KDM4EFFAR1CYP1A2
SCHEMBL6251280 0.72 PTGS2 (0.51) PTGS2KDM4EHSD17B10HPGDCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2571090-B9 NONAQUEOUS-ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEM CORP (JP) 2017-03-15 EP disclosed
US-9553333-B2 Nonaqueous electrolytic solution and nonaqueous electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2017-01-24 US disclosed
EP-2571090-B1 NONAQUEOUS-ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEM CORP (JP) 2016-09-07 EP disclosed
US-20150044554-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2015-02-12 US disclosed
US-20130216919-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2013-08-22 US disclosed
EP-2618418-A1 NONAQUEOUS ELECTROLYTE AND NONAQUEOUS ELECTROLYTE SECONDARY BATTERY Mitsubishi Chemical Corporation (JP) 2013-07-24 EP disclosed
US-20130071731-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2013-03-21 US disclosed
US-20130071730-A1 NONAQUEOUS ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2013-03-21 US disclosed
EP-2571089-A1 NON-AQUEOUS ELECTROLYTIC SOLUTION, AND NON-AQUEOUS ELECTROLYTE SECONDARY BATTERY Mitsubishi Chemical Corporation (JP) 2013-03-20 EP disclosed
EP-2571090-A1 NONAQUEOUS-ELECTROLYTE SECONDARY BATTERY Mitsubishi Chemical Corporation (JP) 2013-03-20 EP disclosed