SCHEMBL9375381

SCHEMBL9375381

CCOC(=O)CCCCSc1nc(-c2ccccc2)c(-c2ccccc2)[nH]1

nearest known ligand 0.65

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.55
MAPK14 Q16539 1/20 0.54

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
SCHEMBL9159182 0.99
SCHEMBL9651659 0.99
SCHEMBL9347959 0.88 MAPK14 (0.56) MAPK14
SCHEMBL9370590 0.85 KDM4E (0.67) KDM4E
SCHEMBL9370221 0.83 KDM4E (0.62) KDM4E
SCHEMBL9651625 0.83 KDM4E (0.66) KDM4E
SCHEMBL9666422 0.83 KDM4E (0.66) KDM4E
SCHEMBL8112795 0.83 KDM4E (0.66) KDM4E
SCHEMBL9210387 0.82 KDM4E (0.64) KDM4E
SCHEMBL9666017 0.81 KDM4E (0.60) KDM4E

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
US-5318984-A Anticholesterol agents which inhibit acetyl coenzyme A transferase THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1994-06-07 US disclosed
EP-0372445-B1 Imidazoles for the treatment of atherosclerosis DU PONT MERCK PHARMA (US) 1994-03-09 EP disclosed
US-5166214-A Enzyme inhibitors for anticholesterol agents, enzyme inhibitor and cardiovascular disorders DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1992-11-24 US disclosed
WO-1991018885-A1 IMIDAZOLES FOR THE TREATMENT OF ATHEROSCLEROSIS THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1991-12-12 WO disclosed
EP-0372445-A1 Imidazoles for the treatment of atherosclerosis THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1990-06-13 EP disclosed