SCHEMBL14076263

SCHEMBL14076263

COc1ccc2nc(-c3ccc(-c4nc5ccc(C)cc5nc4-c4ccccc4)cc3)c(-c3ccccc3)nc2c1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.73
KDM4E B2RXH2 7/20 0.73
L3MBTL1 Q9Y468 5/20 0.73
LMNA P02545 4/20 0.67
TDP1 Q9NUW8 3/20 0.67
NPSR1 Q6W5P4 2/20 0.67
MEN1 O00255 3/20 0.58
KMT2A Q03164 3/20 0.58
POLB P06746 2/20 0.58
NQO2 P16083 2/20 0.58
RAB9A P51151 2/20 0.58
SMN1; SMN2 Q16637 2/20 0.58
NPC1 O15118 1/20 0.58
RECQL P46063 2/20 0.57
MAPK1 P28482 1/20 0.57
MAPK14 Q16539 1/20 0.57
MAPT P10636 3/20 0.54
GPR55 Q9Y2T6 1/20 0.54
TP53 P04637 4/20 0.52
ALOX12 P18054 2/20 0.51

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
SCHEMBL12062005 0.95 ALDH1A1 (0.76) ALDH1A1KDM4EL3MBTL1LMNATDP1
SCHEMBL8112450 0.91 KDM4E (0.74) ALDH1A1KDM4EL3MBTL1LMNATDP1
SCHEMBL31070199 0.91 KDM4E (0.74) ALDH1A1KDM4EL3MBTL1LMNATDP1
SCHEMBL12577911 0.89 ALDH1A1 (0.64) ALDH1A1KDM4EL3MBTL1LMNATDP1
SCHEMBL14492817 0.89 ALDH1A1 (0.64) ALDH1A1KDM4EL3MBTL1LMNATDP1
SCHEMBL12341701 0.88 ALDH1A1 (0.71) ALDH1A1KDM4EL3MBTL1LMNATDP1
SCHEMBL12553477 0.87 KDM4E (0.96) ALDH1A1KDM4EL3MBTL1LMNATDP1
SCHEMBL825060 0.87 KDM4E (0.96) ALDH1A1KDM4EL3MBTL1LMNATDP1
SCHEMBL18083001 0.86 ALDH1A1 (0.93) ALDH1A1KDM4EL3MBTL1LMNATDP1
SCHEMBL31415566 0.86 KDM4E (1.00) ALDH1A1KDM4EL3MBTL1LMNATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080226985-A1 High temperature cycle properties, inexpensive electrode material; polyphenylquinoxaline active material; secondary batteries, electric double layer capacitors, redox capacitors, condensers NEC TOKIN CORPORATION (JP) 2008-09-18 US disclosed
US-7226695-B2 Polymerr\\conductive electrode, dehydration condensation polymer with tetramine derivatives of quinoxaline derivatives for batteries SHOWA DENKO K.K. (JP) 2007-06-05 US disclosed