SCHEMBL9159182

SCHEMBL9159182

CCOC(=O)CCCCCCCSc1nc(-c2ccccc2)c(-c2ccccc2)[nH]1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL9651659 1.00
SCHEMBL9375381 0.99 KDM4E (0.55)
SCHEMBL9347959 0.87 MAPK14 (0.56)
SCHEMBL9666422 0.85 KDM4E (0.66)
SCHEMBL8112795 0.85 KDM4E (0.66)
SCHEMBL9651625 0.85 KDM4E (0.66)
SCHEMBL9370590 0.84 KDM4E (0.67)
SCHEMBL9666017 0.83 KDM4E (0.60)
SCHEMBL9370221 0.83 KDM4E (0.62)
SCHEMBL9212895 0.82 ACAT1 (0.66)

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0359197-B1 ANTIHYPERCHOLESTEROLEMIC 4,5-DIARYL-2-SUBSTITUTED THIOIMIDAZOLES THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1992-12-23 EP claimed
EP-0359197-A1 Antihypercholesterolemic 4,5-diaryl-2-substituted thioimidazoles THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1990-03-21 EP claimed
US-4900744-A Antihypercholesterolemic 4,5-diaryl-2-substituted thioimidazoles E. I. DU PONT DE NEMOURS AND COMPANY (US) 1990-02-13 US claimed
JP-2174762-A None JP disclosed
US-5478830-A Pyrazolo pyrimidines; inhibitors of acyl-coenzyme A and cholesterol acyltransferase; antihypercholesterolemic agents THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1995-12-26 US disclosed
US-5364875-A Anticholesterol agents THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1994-11-15 US disclosed
US-5358946-A Heterocycle-substituted amides, carbamates and ureas as agents for the treatment of atherosclerosis THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1994-10-25 US disclosed
US-5310748-A Anticholesterol agents THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1994-05-10 US disclosed
US-5290801-A Anticholesterol or antilipemic agents THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1994-03-01 US disclosed
WO-1993023381-A1 IMIDAZOLES FOR THE TREATMENT OF ATHEROSCLEROSIS THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1993-11-25 WO disclosed
WO-1993023392-A1 IMIDAZOLES LINKED TO BICYCLIC HETEROCYCLIC GROUPS FOR THE TREATMENT OF ATHEROSCLEROSIS THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1993-11-25 WO disclosed
EP-0359197-B1 ANTIHYPERCHOLESTEROLEMIC 4,5-DIARYL-2-SUBSTITUTED THIOIMIDAZOLES THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1992-12-23 EP disclosed
JP-H02174762-A ANTI-HYPERCHOLSETEROLEMIA AGENT, 4,5-DIARYL-2-SUBSTITUTED THIOIMIDAZOLE E I DU PONT DE NEMOURS & CO 1990-07-06 JP disclosed
EP-0359197-A1 Antihypercholesterolemic 4,5-diaryl-2-substituted thioimidazoles THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1990-03-21 EP disclosed
EP-0359197-A1 Antihypercholesterolemic 4,5-diaryl-2-substituted thioimidazoles THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1990-03-21 EP disclosed
US-4900744-A Antihypercholesterolemic 4,5-diaryl-2-substituted thioimidazoles E. I. DU PONT DE NEMOURS AND COMPANY (US) 1990-02-13 US disclosed
US-4900744-A Antihypercholesterolemic 4,5-diaryl-2-substituted thioimidazoles E. I. DU PONT DE NEMOURS AND COMPANY (US) 1990-02-13 US disclosed