SCHEMBL6533973

SCHEMBL6533973

CNC(=O)c1cc(C(N)=O)n(-c2ccccc2)n1

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MALT1 Q9UDY8 3/20 0.57
▸ MEN1 O00255 1/20 0.57
▸ KMT2A Q03164 1/20 0.57
▸ BRD4 O60885 7/20 0.54
▸ NFKB1 P19838 1/20 0.48
▸ NFKB2 Q00653 1/20 0.48
▸ RELA Q04206 1/20 0.48
▸ NTRK1 P04629 2/20 0.47
▸ SCN9A Q15858 3/20 0.46
▸ SCN10A Q9Y5Y9 1/20 0.46
▸ NPY5R Q15761 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.44
▸ GAA P10253 1/20 0.44

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
SCHEMBL18693719 0.82 MALT1 (0.60) MALT1MEN1KMT2ABRD4NFKB1
SCHEMBL3074249 0.77 TSHR (0.58) KMT2ANTRK1ALDH1A1GAA
SCHEMBL23185619 0.77 BRD4 (0.85) BRD4
SCHEMBL24797867 0.77 BRD4 (0.85) BRD4
SCHEMBL4718807 0.74 GRN (0.78) KMT2AALDH1A1GAA
SCHEMBL18909745 0.73 MALT1 (0.55) MALT1ALDH1A1GAA
SCHEMBL27172726 0.73 ALDH1A1 (0.63) MEN1KMT2AALDH1A1
SCHEMBL20661050 0.72 ALDH1A1 (0.49) KMT2ANTRK1SCN9ASCN10AALDH1A1
SCHEMBL69400 0.72 SMN1; SMN2 (0.60) MEN1KMT2AALDH1A1GAA
SCHEMBL68764 0.72 RPA1 (0.65) MEN1KMT2AALDH1A1GAA

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
EP-4171226-A1 METHODS AND COMPOSITIONS FOR USE IN GLUED-WOOD PRODUCTS Arxada AG (CH) 2023-05-03 — — EP disclosed
EP-1599463-A1 CYANO ANTHRANILAMIDE INSECTICIDES E.I. du Pont de Nemours and Company (US) 2005-11-30 — — EP disclosed
WO-2004067528-A1 CYANO ANTHRANILAMIDE INSECTICIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 2004-08-12 — — WO disclosed
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