SCHEMBL6433592

SCHEMBL6433592

O=C(Cc1ccccn1)Nc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.68

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.65
MEN1 O00255 5/20 0.65
NPC1 O15118 1/20 0.65
RAB9A P51151 1/20 0.65
CA1 P00915 1/20 0.64
CA2 P00918 1/20 0.64
CA5A P35218 1/20 0.64
CA7 P43166 1/20 0.64
CA5B Q9Y2D0 1/20 0.64
L3MBTL1 Q9Y468 1/20 0.62
ALDH1A1 P00352 5/20 0.54
MAPT P10636 3/20 0.54
HTT P42858 1/20 0.54
HSP90AA1 P07900 1/20 0.53
KDR P35968 2/20 0.53
LMNA P02545 1/20 0.52

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
SCHEMBL2028409 0.82 CA1 (0.69) KMT2AMEN1NPC1RAB9ACA1
SCHEMBL3006426 0.82 RAB9A (0.71) KMT2AMEN1NPC1RAB9ACA1
SCHEMBL2183629 0.81 NPC1 (0.71) KMT2AMEN1NPC1RAB9AL3MBTL1
SCHEMBL6794968 0.80 L3MBTL1 (0.62) KMT2AMEN1L3MBTL1ALDH1A1MAPT
SCHEMBL6491441 0.80 CA1 (0.71) KMT2AMEN1NPC1RAB9ACA1
SCHEMBL10576461 0.80 CA1 (0.67) NPC1RAB9ACA1CA2CA5A
SCHEMBL3453018 0.80 CA1 (0.67) KMT2AMEN1NPC1RAB9ACA1
SCHEMBL18546011 0.80 CA1 (0.66) NPC1RAB9ACA1CA2CA5A
SCHEMBL29765433 0.79 CA1 (0.65) KMT2AMEN1NPC1RAB9ACA1
SCHEMBL27841700 0.79 MEN1 (0.74) KMT2AMEN1NPC1RAB9ACA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1224163-B1 USE OF CARBONYLAMINO DERIVATIVES AGAINST CNS DISORDERS HOFFMANN LA ROCHE (CH) 2005-03-30 EP disclosed
US-20040058903-A1 Benzamide compounds as apo b secretion inhibitors FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-03-25 US disclosed
CN-1478077-A Benzamide compounds as APO B secretion inhibitors ����ҩƷ��ҵ��ʽ���� 2004-02-25 CN disclosed
EP-1326835-A1 BENZAMIDE COMPOUNDS AS APO B SECRETION INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-07-16 EP disclosed
US-6548522-B1 N-substituted 2,2-diphenylacetamide or N-substituted 2-phenyl-2-pyridinylacetamide HOFFMANN-LA ROCHE INC. 2003-04-15 US disclosed
EP-1224163-A1 USE OF CARBONYLAMINO DERIVATIVES AGAINST CNS DISORDERS F. HOFFMANN-LA ROCHE AG (CH) 2002-07-24 EP disclosed
WO-2002028835-A1 BENZAMIDE COMPOUNDS AS APO B SECRETION INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-04-11 WO disclosed
WO-2001027070-A1 USE OF CARBONYLAMINO DERIVATIVES AGAINST CNS DISORDERS F. HOFFMANN-LA ROCHE AG (CH) 2001-04-19 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 KMT2A 2457/4885MEN1 2426/4885NPC1 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.