SCHEMBL7496709

SCHEMBL7496709

CC(C)=N/N=C1\NC(=O)C(Cc2ccc(Cc3ccccc3)cc2)N1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 2/20 0.42
MAPT P10636 1/20 0.41
NR0B1 P51843 1/20 0.40
LMNA P02545 1/20 0.38
MMP1 P03956 2/20 0.37
MMP3 P08254 2/20 0.37
MMP9 P14780 2/20 0.37
TACR1 P25103 2/20 0.36
DDB1 Q16531 1/20 0.36
CRBN Q96SW2 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
SCHEMBL7496713 1.00 HDAC8 (0.42) HDAC8MAPTNR0B1LMNAMMP1
SCHEMBL7495854 0.96 HDAC8 (0.44) HDAC8MAPTNR0B1MMP1MMP3
SCHEMBL7495862 0.96 HDAC8 (0.44) HDAC8MAPTNR0B1MMP1MMP3
SCHEMBL7494331 0.88 MAPT (0.37) HDAC8MAPTNR0B1TACR1DDB1
SCHEMBL7494338 0.88 MAPT (0.37) HDAC8MAPTNR0B1TACR1DDB1
SCHEMBL7493846 0.87 MEN1 (0.46) LMNAMMP1MMP3MMP9
SCHEMBL7493838 0.87 MEN1 (0.46) LMNAMMP1MMP3MMP9
SCHEMBL7492804 0.87 CAPN1 (0.40) MAPTNR0B1
SCHEMBL7492801 0.87 CAPN1 (0.40) MAPTNR0B1
SCHEMBL7491481 0.86 HRH3 (0.44) MMP1MMP3MMP9

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-0638075-B1 THIAZOLE OR IMIDAZOLE DERIVATIVES AS MAILLARD REACTION INHIBITORS OTSUKA PHARMA CO LTD (JP) 2002-01-16 EP disclosed
WO-1998043649-A2 AGE PRODUCTION INHIBITORY COMPOSITION COMPRISING A MAILLARD REACTION INHIBITOR AND VITAMIN B¿6? OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1998-10-08 WO disclosed
US-5677322-A THERAPY FOR AGING, DIABETES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-10-14 US disclosed