SCHEMBL7811547

SCHEMBL7811547

O=Cc1cccc([N+](=O)[O-])c1OCc1ccccc1[N+](=O)[O-]

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.49
ADRA1D P25100 1/20 0.49
ADRA1A P35348 1/20 0.49
ADRA1B P35368 1/20 0.49
ERN1 O75460 1/20 0.49
MAOB P27338 1/20 0.48
ALDH1A1 P00352 7/20 0.46
HTT P42858 2/20 0.46
LMNA P02545 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
TSHR P16473 1/20 0.45
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
RECQL P46063 1/20 0.44
KMT2A Q03164 2/20 0.43
CA12 O43570 1/20 0.43
CA9 Q16790 1/20 0.43
CCR5 P51681 1/20 0.42
HPGD P15428 2/20 0.42
MAPT P10636 2/20 0.41

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
SCHEMBL4585380 0.86 NPC1 (0.53) HTR1AADRA1DADRA1AADRA1BERN1
SCHEMBL5483975 0.84 HTR1A (0.56) HTR1AADRA1DADRA1AADRA1BERN1
SCHEMBL8581084 0.78 ERN1 (0.50) ERN1ALDH1A1HTTLMNASMN1; SMN2
SCHEMBL10458181 0.78 ERN1 (0.50) HTR1AADRA1DADRA1AADRA1BERN1
SCHEMBL3099586 0.78 NPC1 (0.49) HTR1AADRA1DADRA1AADRA1BERN1
SCHEMBL14228209 0.77 ERN1 (0.49) HTR1AADRA1DADRA1AADRA1BERN1
SCHEMBL28340296 0.77 ERN1 (0.49) ERN1ALDH1A1HTTLMNASMN1; SMN2
SCHEMBL4164827 0.77 ERN1 (0.53) ERN1MAOBALDH1A1HTTLMNA
SCHEMBL4164822 0.77 ERN1 (0.53) ERN1MAOBALDH1A1HTTLMNA
SCHEMBL27295142 0.77 ERN1 (0.49) ERN1ALDH1A1HTTLMNASMN1; SMN2

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-0780363-B1 Bisazo-benzofuran compounds, their use as charge carrier generating compounds SHARP KK (JP) 2001-09-26 EP claimed
EP-0780363-A1 Bisazo-benzofuran compounds, their use as charge carrier generating compounds and intermediates for their preparation SHARP KABUSHIKI KAISHA (JP) 1997-06-25 EP claimed
EP-0780363-B1 Bisazo-benzofuran compounds, their use as charge carrier generating compounds SHARP KK (JP) 2001-09-26 EP disclosed
US-5853930-A Electrophotographic photoconductors using bisazo compounds SHARP KABUSHIKI KAISHA (JP) 1998-12-29 US disclosed
EP-0780363-A1 Bisazo-benzofuran compounds, their use as charge carrier generating compounds and intermediates for their preparation SHARP KABUSHIKI KAISHA (JP) 1997-06-25 EP disclosed