SCHEMBL6609826

SCHEMBL6609826

CN(C)c1ccc(-c2nc(-c3ccccc3/C=C/c3nc4ccccc4o3)[nH]c2-c2ccc(N(C)C)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NOX1 Q9Y5S8 1/20 0.51
▸ ALOX5 P09917 2/20 0.41
▸ MAPT P10636 3/20 0.38
▸ RXFP1 Q9HBX9 1/20 0.38
▸ MGAM O43451 1/20 0.37
▸ NPC1 O15118 4/20 0.37
▸ RAB9A P51151 4/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ GAA P10253 1/20 0.37
▸ CASP3 P42574 1/20 0.37
▸ SENP8 Q96LD8 1/20 0.37
▸ SENP6 Q9GZR1 1/20 0.37
▸ KDM4E B2RXH2 3/20 0.36
▸ HCRTR1 O43613 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ NFKB1 P19838 1/20 0.36
▸ STAT1 P42224 1/20 0.36
▸ NFKB2 Q00653 1/20 0.36

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
SCHEMBL3824183 0.94 NOX1 (0.45) NOX1ALOX5MAPTRXFP1MGAM
SCHEMBL3828923 0.88 NOX1 (0.40) NOX1ALOX5MAPTRXFP1NPC1
SCHEMBL3830694 0.84 MEN1 (0.37) NOX1MAPTMGAMNPC1RAB9A
SCHEMBL6607624 0.78 MEN1 (0.55) NOX1ALOX5MAPTMGAMNPC1
SCHEMBL3825381 0.78 KDM4E (0.36) ALOX5MAPTMGAMNPC1RAB9A
SCHEMBL8720952 0.75 MAPT (0.43) NOX1ALOX5MAPTRXFP1MGAM
SCHEMBL3826536 0.73 MEN1 (0.48) NOX1ALOX5MAPTMGAMNPC1
SCHEMBL476617 0.72 MEN1 (0.59) MAPTRXFP1NPC1RAB9AMEN1
SCHEMBL476616 0.72 MEN1 (0.59) MAPTRXFP1NPC1RAB9AMEN1
SCHEMBL29397958 0.72 MEN1 (0.59) MAPTRXFP1NPC1RAB9AMEN1

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-0999835-A4 IMIDAZOLE DERIVATIVES AS MDR MODULATORS ONTOGEN CORP (US) 2004-08-25 — — EP disclosed
EP-0999835-A1 IMIDAZOLE DERIVATIVES AS MDR MODULATORS Ontogen Corporation (US) 2000-05-17 — — EP disclosed
WO-1999002155-A1 IMIDAZOLE DERIVATIVES AS MDR MODULATORS ONTOGEN CORPORATION (US) 1999-01-21 — — WO disclosed
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