SCHEMBL7496459

SCHEMBL7496459

CCCC(=O)Oc1c(Cl)cccc1Sc1ccc(Cl)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.47
GAA P10253 3/20 0.47
TP53 P04637 2/20 0.47
POLB P06746 2/20 0.46
LMNA P02545 3/20 0.44
CHRM2 P08172 1/20 0.42
CHRM1 P11229 1/20 0.42
CHRM3 P20309 1/20 0.42
ALDH1A1 P00352 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
BLM P54132 1/20 0.40
NOD2 Q9HC29 1/20 0.40
AKR1B1 P15121 2/20 0.40
PTGDR2 Q9Y5Y4 2/20 0.40
SLC6A9 P48067 1/20 0.39
RHEB Q15382 4/20 0.38
SLC6A4 P31645 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.37
HTT P42858 1/20 0.37
KDM4E B2RXH2 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
SCHEMBL11277533 0.80 KMT2A (0.46) ALDH1A1HTTKDM4E
SCHEMBL27450909 0.74 SMN1; SMN2 (0.42) GAATP53POLBALDH1A1L3MBTL1
Hydrochloric Acid SCHEMBL28401106 0.72 ABCB11 (0.40) ALDH1A1L3MBTL1HTTKDM4E
SCHEMBL5468900 0.69 BCL9 (0.60) MAPTGAALMNAALDH1A1HTT
SCHEMBL29152244 0.69 POLM (0.50) MAPTLMNAALDH1A1HTTKDM4E
SCHEMBL29372461 0.69 CNR2 (0.38) LMNAALDH1A1HTTKDM4E
SCHEMBL2898218 0.67 KMT2A (0.48) ALDH1A1AKR1B1HTT
SCHEMBL4573844 0.67 KMT2A (0.45) GAALMNAALDH1A1NPSR1L3MBTL1
SCHEMBL15558766 0.67 KMT2A (0.56) LMNAALDH1A1L3MBTL1HTTKDM4E
SCHEMBL29371382 0.67 ABCB11 (0.50) MAPTGAATP53POLBALDH1A1

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 4 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
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