SCHEMBL6492795

SCHEMBL6492795

O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1ccccn1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.67
▸ KMT2A Q03164 8/20 0.67
▸ MEN1 O00255 5/20 0.67
▸ SLC6A2 P23975 1/20 0.67
▸ SLC6A3 Q01959 1/20 0.67
▸ L3MBTL1 Q9Y468 3/20 0.65
▸ ALDH1A1 P00352 6/20 0.61
▸ MAPT P10636 5/20 0.61
▸ SMN1; SMN2 Q16637 5/20 0.61
▸ LMNA P02545 2/20 0.61
▸ RAB9A P51151 3/20 0.57
▸ NPC1 O15118 2/20 0.57
▸ STAT1 P42224 1/20 0.57
▸ GAA P10253 3/20 0.56
▸ PKM P14618 1/20 0.55
▸ HTT P42858 1/20 0.54
▸ HPGD P15428 1/20 0.54
▸ TP53 P04637 1/20 0.54
▸ ESR1 P03372 1/20 0.51
▸ STAT3 P40763 1/20 0.51

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
SCHEMBL4908980 0.82 KMT2A (0.82) POLBKMT2AMEN1SLC6A2SLC6A3
SCHEMBL1476618 0.81 DEGS1 (0.64) POLBKMT2AMEN1ALDH1A1MAPT
SCHEMBL29270879 0.80 KMT2A (1.00) POLBKMT2AMEN1SLC6A2SLC6A3
Difenpiramide SCHEMBL29238669 0.80 KMT2A (1.00) POLBKMT2AMEN1SLC6A2SLC6A3
Difenpiramide SCHEMBL23833 0.80 KMT2A (1.00) POLBKMT2AMEN1SLC6A2SLC6A3
SCHEMBL6490488 0.80 KMT2A (0.74) POLBKMT2AMEN1SLC6A2SLC6A3
SCHEMBL28194116 0.80 KMT2A (0.68) POLBKMT2AMEN1SLC6A2SLC6A3
SCHEMBL8212003 0.79 MEN1 (0.81) POLBKMT2AMEN1ALDH1A1MAPT
SCHEMBL5204557 0.77 CXCR4 (0.70) POLBKMT2AMEN1L3MBTL1ALDH1A1
SCHEMBL4575591 0.77 KMT2A (0.68) KMT2AMEN1SLC6A2SLC6A3L3MBTL1

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
US-20050038035-A1 Heterocyclic amide compounds as apolipoprotein b inhibitors DAISO CO., LTD. (JP) 2005-02-17 — — US disclosed
EP-1472226-A1 HETEROCYCLIC AMIDE COMPOUNDS AS APOLIPOPROTEIN B INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-11-03 — — EP disclosed
WO-2003045921-A1 HETEROCYCLIC AMIDE COMPOUNDS AS APOLIPOPROTEIN B INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-06-05 — — 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-20050038035-A1 Heterocyclic amide compounds as apolipoprotein b inhibitors APOB, APOL1, CTRB2 POLB 1626/4885KMT2A 573/4885MEN1 1991/4885

“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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