SCHEMBL5486818

SCHEMBL5486818

CCCCP(C)(=O)Oc1ccccc1C

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.40
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C19 P33261 1/20 0.38
MAPT P10636 1/20 0.38
TSHR P16473 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
ALDH1A1 P00352 1/20 0.37
GLA P06280 1/20 0.37

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
SCHEMBL5487473 0.90 KDM4E (0.42) KDM4ECYP1A2CYP3A4CYP2C19MAPT
SCHEMBL5485257 0.85 KDM4E (0.41) KDM4ECYP1A2MAPTTSHRTDP1
SCHEMBL778988 0.85 KDM4E (0.41) KDM4EMAPTTSHR
SCHEMBL5487523 0.82 KDM4E (0.44) KDM4ECYP1A2CYP3A4CYP2C19MAPT
SCHEMBL5488177 0.82 KDM4E (0.39) KDM4EMAPTTSHRTDP1
SCHEMBL5488255 0.82 KDM4E (0.39) KDM4ECYP1A2MAPTTSHRTDP1
SCHEMBL778989 0.82 CETP (0.50) TSHRTDP1
SCHEMBL13430894 0.80 CETP (0.42) KDM4EMAPT
SCHEMBL15501829 0.78 CYP1A2 (0.40) CYP1A2CYP3A4CYP2C19
SCHEMBL5487586 0.77 KDM4E (0.43) KDM4ECYP1A2CYP3A4CYP2C19MAPT

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
US-20070087270-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND NONAQUEOUS ELECTROLYTE SOLUTION SECONDARY BATTERY EMPLOYING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2007-04-19 US disclosed
US-7169511-B2 Nonaqueous electrolyte solution and nonaqueous electrolyte solution secondary battery employing the same MITSUBISHI CHEMICAL CORPORATION (JP) 2007-01-30 US disclosed
EP-1555711-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS ELECTROLYTE SECONDARY BATTERY CONTAINING THE SAME Mitsubishi Chemical Corporation (JP) 2005-07-20 EP disclosed
US-20050014071-A1 Nonaqueous electrolyte solution and nonaqueous electrolyte solution secondary battery employing the same MITSUBISHI CHEMICAL CORPORATION (JP) 2005-01-20 US disclosed