SCHEMBL7490465

SCHEMBL7490465

COC(=O)NCCCCC1N/C(=N/N=C(C)C)NC1=O

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TPSAB1 Q15661 3/20 0.38
EPHX1 P07099 1/20 0.36
SIRT2 Q8IXJ6 4/20 0.31
SIRT1 Q96EB6 4/20 0.31
SIRT3 Q9NTG7 4/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HSD17B10 Q99714 1/20 0.31
GAA P10253 1/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL7490470 1.00 TPSAB1 (0.38) TPSAB1EPHX1SIRT2SIRT1SIRT3
SCHEMBL7490519 0.83 IDO1 (0.49) TPSAB1MAPT
SCHEMBL7490523 0.83 IDO1 (0.49) TPSAB1MAPT
SCHEMBL15298425 0.79 TPSAB1 (0.51) TPSAB1EPHX1SIRT2SIRT1SIRT3
SCHEMBL7493856 0.76 GAA (0.41) KDM4EALDH1A1HSD17B10GAAMAPT
SCHEMBL7493852 0.76 GAA (0.41) KDM4EALDH1A1HSD17B10GAAMAPT
SCHEMBL15298501 0.72 TPSAB1 (0.45) TPSAB1EPHX1SIRT2SIRT1SIRT3
SCHEMBL7491115 0.71 GAA (0.33) GAA
SCHEMBL7492787 0.71 KDM4E (0.34) KDM4EALDH1A1HSD17B10GAAMAPT
SCHEMBL7491118 0.71 GAA (0.33) GAA

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 5 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 claimed
EP-0638075-B1 THIAZOLE OR IMIDAZOLE DERIVATIVES AS MAILLARD REACTION INHIBITORS OTSUKA PHARMA CO LTD (JP) 2002-01-16 EP disclosed
US-5677322-A THERAPY FOR AGING, DIABETES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-10-14 US disclosed
EP-0638075-A1 THIAZOLE OR IMIDAZOLE DERIVATIVES AS MAILLARD REACTION INHIBITORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-02-15 EP disclosed
WO-1994019335-A1 THIAZOLE OR IMIDAZOLE DERIVATIVES AS MAILLARD REACTION INHIBITORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-09-01 WO disclosed