SCHEMBL19213933

SCHEMBL19213933

CCCOC1=CC(=O)C(OC)=CC1=O

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ERBB2 P04626 1/20 0.43
▸ ALOX5 P09917 17/20 0.42
▸ HKDC1 Q2TB90 1/20 0.41
▸ MPEG1 Q2M385 3/20 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
SCHEMBL11252366 0.91 PTPRC (0.38) ALOX5
SCHEMBL11251067 0.80 ALOX5 (0.42) ALOX5MPEG1
SCHEMBL49737 0.79 ERBB2 (0.62) ERBB2ALOX5HKDC1
SCHEMBL11698807 0.77 ALOX5 (0.45) ALOX5MPEG1
SCHEMBL155738 0.77 ALOX5 (0.45) ALOX5MPEG1
SCHEMBL28856262 0.77 ERBB2 (0.59) ERBB2ALOX5HKDC1
SCHEMBL10446704 0.76 KDR (0.45) ERBB2HKDC1
SCHEMBL5712771 0.75 ERBB2 (0.54) ERBB2ALOX5HKDC1
SCHEMBL11229232 0.72 ERBB2 (0.45) ERBB2ALOX5HKDC1
SCHEMBL5441061 0.72 PTPRC (0.55) ERBB2ALOX5HKDC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170229738-A1 ELECTROLYTE FOR NONAQUEOUS SECONDARY BATTERY AND NONAQUEOUS SECONDARY BATTERY USING THE SAME NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2017-08-10 — — US disclosed
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