SCHEMBL3398362

SCHEMBL3398362

CCOP(=O)(Oc1cccc(C(C)(C)C)c1)Oc1cccc(C(C)(C)C)c1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SOD1 P00441 1/20 0.43
POLB P06746 2/20 0.42
MEN1 O00255 1/20 0.42
GAA P10253 1/20 0.42
KMT2A Q03164 1/20 0.42
ACHE P22303 2/20 0.41
CA2 P00918 2/20 0.41
CA1 P00915 1/20 0.41
BCHE P06276 1/20 0.41
HMGCR P04035 1/20 0.39
LMNA P02545 1/20 0.39
HTT P42858 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
GRM2 Q14416 1/20 0.38

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
SCHEMBL1790484 0.97 POLB (0.45) SOD1POLBMEN1GAAKMT2A
SCHEMBL1786941 0.87 SOD1 (0.45) SOD1POLBGAAACHELMNA
SCHEMBL22928234 0.85 CCNT1 (0.43) SOD1POLBACHEHMGCRLMNA
SCHEMBL20710757 0.82 L3MBTL1 (0.49) MEN1GAAKMT2AACHECA2
SCHEMBL27558363 0.82 CYP3A4 (0.40) CYP3A4
SCHEMBL3396886 0.82 L3MBTL1 (0.45) SOD1POLBGAAACHELMNA
SCHEMBL1787920 0.82 L3MBTL1 (0.45) SOD1POLBGAAACHELMNA
SCHEMBL3400425 0.82 SOD1 (0.42) SOD1POLBGAAACHELMNA
SCHEMBL1787386 0.82 SOD1 (0.42) SOD1POLBGAAACHELMNA
SCHEMBL7772917 0.81 MEN1 (0.54) POLBMEN1GAAKMT2AACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2249426-B1 NONAQUEOUS ELECTROLYTE SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY MITSUBISHI CHEM CORP (JP) 2019-07-10 EP disclosed
US-20140134481-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS-ELECTROLYTE BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2014-05-15 US disclosed
EP-2249426-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY Mitsubishi Chemical Corporation (JP) 2010-11-10 EP disclosed