SCHEMBL5864193

SCHEMBL5864193

Cc1nc2ccc([N+](=O)[O-])cc2c(=O)n1Cc1ccccc1

nearest known ligand 0.88

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 6/20 0.88
▸ KMT2A Q03164 6/20 0.88
▸ POLB P06746 2/20 0.81
▸ DHFR P00374 2/20 0.64
▸ ALDH1A1 P00352 1/20 0.54
▸ PKM P14618 1/20 0.54
▸ HPGD P15428 1/20 0.54
▸ SMN1; SMN2 Q16637 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
SCHEMBL2315638 0.88 MEN1 (0.83) MEN1KMT2APOLBDHFRALDH1A1
SCHEMBL28987743 0.82 MEN1 (0.71) MEN1KMT2APOLB
SCHEMBL31441369 0.82 MEN1 (0.71) MEN1KMT2APOLB
SCHEMBL28596594 0.81 MEN1 (0.70) MEN1KMT2APOLB
SCHEMBL31196722 0.81 SMN1; SMN2 (0.70) MEN1KMT2APOLBALDH1A1HPGD
SCHEMBL5863348 0.80 KDM4E (0.81) MEN1KMT2APOLBDHFRALDH1A1
SCHEMBL26758120 0.80 MEN1 (0.67) MEN1KMT2APOLBSMN1; SMN2
Water SCHEMBL27728020 0.79 MEN1 (0.66) MEN1KMT2APOLB
SCHEMBL7425922 0.78 MEN1 (0.67) MEN1KMT2APOLBALDH1A1
SCHEMBL12789340 0.78 MEN1 (0.55) MEN1KMT2APOLBDHFRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7030120-B2 Nitrogen-containing heterocyclic compounds and benzamide compounds and drugs containing the same MEIJI SEIKA KAISHA, LTD. (JP) 2006-04-18 — — US disclosed
US-20040224959-A1 Nitrogen-containing heterocyclic compounds and benzamide compounds and drugs containing the same OHKURA NAOTO (JP) 2004-11-11 — — US disclosed
US-6777414-B1 INHIBITORS OF TRIGLYCERIDE BIOSYNTHESIS AND SECRETION OF APOLIPOPROTEIN B-CONTAINING LIPOPROTEINS; ARTERIOSCLEROTIC DISEASES; HYPERLIPIDEMIA MEIJI SEIKA KAISHA, LTD. (JP) 2004-08-17 — — US disclosed
EP-1180514-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS AND BENAMIDE COMPOUNDS AND DRUGS CONTAINING THE SAME MEIJI SEIKA KAISHA LTD. (JP) 2002-02-20 — — EP 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-20040224959-A1 Nitrogen-containing heterocyclic compounds and benzamide compounds and drugs containing the same APOB, NCEH1, LIPC MEN1 4072/4885KMT2A 2580/4885POLB 1984/4885

“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.

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