SCHEMBL6570302

SCHEMBL6570302

CCCC(OC)(OC)c1cc2c(c([N+](=O)[O-])c1)-c1c(cc([N+](=O)[O-])cc1[N+](=O)[O-])C2=O

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HKDC1 Q2TB90 1/20 0.46
ALDH1A1 P00352 3/20 0.33
MAPT P10636 2/20 0.33
KDM4E B2RXH2 1/20 0.33
KMT2A Q03164 2/20 0.32
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
GAA P10253 1/20 0.32
TDP1 Q9NUW8 2/20 0.32
CYP3A4 P08684 2/20 0.32
MAPK1 P28482 2/20 0.32
TSHR P16473 1/20 0.32
HPRT1 P00492 1/20 0.32
GPR35 Q9HC97 2/20 0.31
HSP90AA1 P07900 1/20 0.31
S100A4 P26447 2/20 0.31
PTPRC P08575 1/20 0.31
TRPV1 Q8NER1 1/20 0.30
HTT P42858 1/20 0.30

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
SCHEMBL359704 0.84 HKDC1 (0.49) HKDC1ALDH1A1MAPTKDM4EKMT2A
SCHEMBL7522376 0.78 HKDC1 (0.56) HKDC1ALDH1A1MAPTKDM4EKMT2A
SCHEMBL74588 0.76 HKDC1 (0.65) HKDC1ALDH1A1MAPTKDM4EKMT2A
SCHEMBL29435119 0.76 HKDC1 (0.65) HKDC1ALDH1A1MAPTKDM4EKMT2A
SCHEMBL12396393 0.70 HKDC1 (0.59) HKDC1ALDH1A1MAPTKDM4EKMT2A
SCHEMBL11359859 0.69 HKDC1 (0.57) HKDC1ALDH1A1MAPTKDM4EKMT2A
SCHEMBL8569104 0.68 HKDC1 (0.50) HKDC1ALDH1A1MAPTKDM4EKMT2A
SCHEMBL6541857 0.68 HKDC1 (0.56) HKDC1ALDH1A1MAPTKDM4EKMT2A
SCHEMBL5947763 0.68 ESR1 (0.57) HKDC1ALDH1A1KMT2AMEN1TDP1
SCHEMBL3207925 0.67 HKDC1 (0.55) HKDC1ALDH1A1MAPTKDM4EKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0785477-B1 Electrophotographic photoreceptor, image forming apparatus and use of this photoreceptor in an image forming process FUJI XEROX CO LTD (JP) 2004-04-14 EP disclosed
US-5795690-A MULTILAYER; ELECTROCONDUCTIVITY SUBSTRATE, CROSSLINKED UNDERCOATINGS AND PHOTOSENSITIVITY FUJI XEROX CO., LTD. (JP) 1998-08-18 US disclosed
EP-0785477-A2 Electrophotographic photoreceptor, image forming apparatus and image forming process FUJI XEROX CO., LTD. (JP) 1997-07-23 EP disclosed