SCHEMBL8147647

SCHEMBL8147647

COC(C)c1cccc(C)c1NC(=O)c1ccc(C(=O)Nc2c(C)cccc2C(C)OC)c2c(C(=O)O)ccc(C(=O)O)c12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.51
KDM4E B2RXH2 1/20 0.42
KMT2A Q03164 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MAPK1 P28482 1/20 0.41
ALDH1A1 P00352 2/20 0.40
NLRP3 Q96P20 1/20 0.39
LMNA P02545 1/20 0.39
PTGER4 P35408 3/20 0.38
NPC1 O15118 1/20 0.37
S1PR4 O95977 1/20 0.37
HSD17B10 Q99714 1/20 0.36
KCNK3 O14649 1/20 0.36
KCNK9 Q9NPC2 1/20 0.36
SORT1 Q99523 1/20 0.36
GAA P10253 1/20 0.36
CRHBP P24387 1/20 0.36
FNTA P49354 1/20 0.36
FNTB P49356 1/20 0.36
CRHR2 Q13324 1/20 0.36

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
SCHEMBL6597515 0.87 POLB (0.56) POLBKDM4EKMT2AL3MBTL1MAPK1
SCHEMBL6598175 0.82 POLB (0.73) POLBKDM4EKMT2AL3MBTL1ALDH1A1
SCHEMBL8145490 0.79 POLB (0.56) POLBKDM4EKMT2AL3MBTL1ALDH1A1
SCHEMBL272817 0.77 POLB (0.65) POLBKDM4EKMT2AL3MBTL1MAPK1
SCHEMBL8141825 0.76 POLB (0.52) POLBKDM4EKMT2AL3MBTL1MAPK1
SCHEMBL6595989 0.75 HSD17B10 (0.61) POLBKDM4EKMT2AALDH1A1NLRP3
SCHEMBL29824483 0.74 KMT2A (0.56) POLBKMT2ALMNA
SCHEMBL7168499 0.74 KMT2A (0.56) POLBKMT2ALMNA
SCHEMBL7886074 0.71 HSD17B10 (0.51) POLBKDM4EKMT2AALDH1A1NLRP3
SCHEMBL28563448 0.70 MYC (0.36) KDM4EALDH1A1HSD17B10

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-6127076-A ELECTROPHOTOSENSITIVE MATERIAL CONTAINING NAPHTHALENETETRACARBOXYLIC ACID DIIMIDE DERIVATIVE AS ELECTRON TRANSPORTING AGENT KYOCERA MITA CORPORATION (JP) 2000-10-03 US disclosed
EP-0962458-A1 New naphthalenetetracarboxylic acid diimides as electron transporting agents in photosensitive material for electrophotography MITA INDUSTRIAL CO. LTD. (JP) 1999-12-08 EP disclosed