SCHEMBL14775346

SCHEMBL14775346

CCc1ccc(OC(=O)Oc2ccc(CC)cc2C2CCCCC2)c(C2CCCCC2)c1

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 15/20 0.48
PTGDR Q13258 7/20 0.45
PTGER2 P43116 1/20 0.45
NUDT1 P36639 1/20 0.40
BACE1 P56817 1/20 0.40

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
SCHEMBL14775412 0.81 PTGDR2 (0.66) PTGDR2PTGDRPTGER2
SCHEMBL2562526 0.77 CYP4F2 (0.46) PTGDR2PTGDR
SCHEMBL28421308 0.77 CAMKK2 (0.47) NUDT1BACE1
SCHEMBL10413291 0.76 PTGDR2 (0.39) PTGDR2PTGDRPTGER2NUDT1BACE1
SCHEMBL10413290 0.75 PTGDR2 (0.37) PTGDR2PTGDRPTGER2NUDT1BACE1
SCHEMBL13586652 0.75 NUDT1 (0.67) NUDT1BACE1
SCHEMBL11712336 0.74 PTGDR2 (0.46) PTGDR2PTGDRPTGER2NUDT1BACE1
SCHEMBL17810318 0.74 KMT2A (0.45) PTGDR2PTGDR
SCHEMBL27832619 0.74 GABRA1 (0.41) PTGDR2NUDT1BACE1
SCHEMBL29013219 0.73 PTGS1 (0.53)

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 6 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
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
EP-2618418-A1 NONAQUEOUS ELECTROLYTE AND NONAQUEOUS ELECTROLYTE SECONDARY BATTERY Mitsubishi Chemical Corporation (JP) 2013-07-24 EP 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