SCHEMBL6791109

SCHEMBL6791109

O=C(/C=C/c1ccc([N+](=O)[O-])cc1)c1ccccn1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.68
LMNA P02545 4/20 0.68
NPC1 O15118 4/20 0.68
RAB9A P51151 4/20 0.68
KDM4E B2RXH2 3/20 0.68
PKM P14618 3/20 0.68
MAOB P27338 5/20 0.68
BCHE P06276 1/20 0.68
ALDH1A1 P00352 2/20 0.62
KMT2A Q03164 3/20 0.61
MEN1 O00255 2/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
SNCA P37840 1/20 0.61
CYP1B1 Q16678 1/20 0.59
MAPK1 P28482 2/20 0.57
HTT P42858 1/20 0.57
HSP90AA1 P07900 1/20 0.55
NR2F2 P24468 1/20 0.55
ADAM17 P78536 1/20 0.55
POLB P06746 1/20 0.54

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
SCHEMBL29870504 1.00 MAPT (0.68) MAPTLMNANPC1RAB9AKDM4E
SCHEMBL6791116 1.00 MAPT (0.68) MAPTLMNANPC1RAB9AKDM4E
SCHEMBL12257967 0.87 MAPT (0.90) MAPTLMNANPC1RAB9AKDM4E
SCHEMBL9227394 0.85 MAPT (0.70) MAPTLMNANPC1RAB9AKDM4E
SCHEMBL8755683 0.85 MAPT (0.70) MAPTLMNANPC1RAB9AKDM4E
SCHEMBL4400320 0.82 MAPT (1.00) MAPTLMNANPC1RAB9AKDM4E
SCHEMBL977480 0.82 MAPT (1.00) MAPTLMNANPC1RAB9AKDM4E
SCHEMBL1604280 0.81 MAPT (0.79) MAPTLMNANPC1RAB9AKDM4E
SCHEMBL3012785 0.81 MAOB (1.00) MAPTLMNARAB9APKMMAOB
SCHEMBL31436352 0.81 MAPT (0.79) MAPTLMNANPC1RAB9AKDM4E

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
CN-110756222-B Nucleoside triphosphate artificial metalloenzyme and preparation and application thereof 陕西师范大学 2022-08-23 CN disclosed
CN-110756222-A Nucleoside triphosphate artificial metalloenzyme and preparation and application thereof 陕西师范大学 2020-02-07 CN disclosed
US-20040058903-A1 Benzamide compounds as apo b secretion inhibitors FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-03-25 US disclosed
EP-1326835-A1 BENZAMIDE COMPOUNDS AS APO B SECRETION INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-07-16 EP disclosed
WO-2002028835-A1 BENZAMIDE COMPOUNDS AS APO B SECRETION INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-04-11 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040058903-A1 Benzamide compounds as apo b secretion inhibitors APOB, APOL1, SCARB1 MAPT 4795/4885LMNA 1239/4885NPC1 64/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.