SCHEMBL6360759

SCHEMBL6360759

Cn1c(=O)n(-c2ccccc2)c(=O)c2ccccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 4/20 1.00
NPEPPS P55786 1/20 0.60
ERCC1 P07992 1/20 0.59
FEN1 P39748 1/20 0.59
ERCC4 Q92889 1/20 0.59
MAPK8 P45983 2/20 0.55
MAPK1 P28482 1/20 0.55
GRM4 Q14833 3/20 0.55
HKDC1 Q2TB90 1/20 0.51
PARG Q86W56 1/20 0.51
ALDH1A1 P00352 3/20 0.50
CYP2C19 P33261 3/20 0.50
KDM4E B2RXH2 3/20 0.50
CYP1A2 P05177 2/20 0.50
CYP2C9 P11712 2/20 0.50
GLA P06280 2/20 0.50
HPGD P15428 2/20 0.50
MAPK9 P45984 1/20 0.50
GSK3A P49840 1/20 0.50
GSK3B P49841 1/20 0.50

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
SCHEMBL12889781 0.87 PGR (0.77) PGRNPEPPSERCC1FEN1ERCC4
SCHEMBL6360771 0.86 PGR (0.75) PGRNPEPPSERCC1FEN1ERCC4
SCHEMBL22055790 0.84 PGR (0.72) PGRNPEPPSERCC1FEN1ERCC4
SCHEMBL6362495 0.83 PGR (0.71) PGRMAPK8MAPK1ALDH1A1CYP2C19
SCHEMBL6362809 0.81 PGR (0.68) PGRMAPK8MAPK1PARGALDH1A1
SCHEMBL19702008 0.81 PGR (0.67) PGRNPEPPSERCC1FEN1ERCC4
SCHEMBL30665027 0.79 ERCC1 (0.69) PGRNPEPPSERCC1FEN1ERCC4
SCHEMBL6366340 0.79 ERCC1 (0.69) PGRNPEPPSERCC1FEN1ERCC4
SCHEMBL13376862 0.79 PGR (0.64) PGRNPEPPSMAPK1GRM4PARG
SCHEMBL29867601 0.78 PGR (0.64) PGRNPEPPSERCC1FEN1ERCC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1317013-B1 NON-AQUEOUS ELECTROLYTE AND SECONDARY CELL USING THE SAME MITSUBISHI CHEM CORP (JP) 2017-03-15 EP disclosed
EP-1477482-B1 NOVEL PHENYLALANINE DERIVATIVE AJINOMOTO KK (JP) 2010-04-14 EP disclosed
US-6942948-B2 Nonaqueous electrolyte solution and secondary battery employing the same MITSUBISHI CHEMICAL CORPORATION (JP) 2005-09-13 US disclosed
US-20030165733-A1 Nonaqueous electrolyte solution and secondary battery employing the same MITSUBISHI CHEMICAL CORPORATION (JP) 2003-09-04 US disclosed
EP-1317013-A1 NON-AQUEOUS ELECTROLYTE AND SECONDARY CELL USING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2003-06-04 EP disclosed