SCHEMBL6454733

SCHEMBL6454733

C=CCn1c(=O)n(CCCCC)c(=O)c2ccccc21

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 6/20 0.56
PGR P06401 2/20 0.56
RORA P35398 2/20 0.56
RORC P51449 2/20 0.56
RORB Q92753 2/20 0.56
TDP1 Q9NUW8 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
NPC1 O15118 1/20 0.49
KDM4E B2RXH2 3/20 0.49
MAPT P10636 1/20 0.49
SMN1; SMN2 Q16637 2/20 0.48
ALDH1A1 P00352 2/20 0.48
PLK1 P53350 1/20 0.48
APOBEC3G Q9HC16 1/20 0.48
HTT P42858 2/20 0.47
LMNA P02545 2/20 0.47
TP53 P04637 1/20 0.47
HPGD P15428 1/20 0.47
RXFP1 Q9HBX9 1/20 0.46

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
SCHEMBL6417441 0.88 CNR2 (0.48) CNR2PGRRORARORCRORB
SCHEMBL6417860 0.87 CNR2 (0.68) CNR2PGRRORARORCRORB
SCHEMBL8523462 0.84 GAA (0.53) L3MBTL1NPC1KDM4EMAPTSMN1; SMN2
SCHEMBL2864756 0.79 CNR2 (0.65) CNR2PGRRORARORCRORB
SCHEMBL14692503 0.77 ADORA2B (0.53) PGRKDM4ESMN1; SMN2ALDH1A1PLK1
SCHEMBL3257738 0.77 RORA (0.90) PGRRORARORCRORBTDP1
SCHEMBL13198597 0.76 CYP3A4 (0.61) L3MBTL1KDM4EMAPTSMN1; SMN2ALDH1A1
SCHEMBL14560541 0.76 PGR (0.67) CNR2PGRRORARORCRORB
SCHEMBL25388740 0.75 CYP3A4 (0.59) KDM4ESMN1; SMN2ALDH1A1HTTLMNA
SCHEMBL13198601 0.75 CYP3A4 (0.59) KDM4ESMN1; SMN2ALDH1A1HTTLMNA

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
EP-1317013-B1 NON-AQUEOUS ELECTROLYTE AND SECONDARY CELL USING THE SAME MITSUBISHI CHEM CORP (JP) 2017-03-15 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