SCHEMBL8112795

SCHEMBL8112795

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

nearest known ligand 0.80

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.66
PTGES O14684 1/20 0.60

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
SCHEMBL9666422 1.00 KDM4E (0.66) KDM4EPTGES
SCHEMBL9651625 1.00 KDM4E (0.66) KDM4EPTGES
SCHEMBL9370590 0.99 KDM4E (0.67) KDM4EPTGES
SCHEMBL9666017 0.90 KDM4E (0.60) KDM4EPTGES
SCHEMBL9370221 0.90 KDM4E (0.62) KDM4EPTGES
SCHEMBL13516893 0.89 KDM4E (0.72) KDM4EPTGES
SCHEMBL9217701 0.89 ACAT1 (0.66) KDM4E
SCHEMBL9212895 0.89 ACAT1 (0.66) KDM4E
SCHEMBL9213347 0.89 ACAT1 (0.66) KDM4E
SCHEMBL9210387 0.88 KDM4E (0.64) 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 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
EP-0626969-B1 CoA-IT AND PAF INHIBITORS SMITHKLINE BEECHAM CORP (US) 2000-05-24 EP disclosed
US-5663053-A COENZYME A TRANSACYLASE FOR SCREENING SMITHKLINE BEECHAM CORPORATION (US) 1997-09-02 US disclosed
US-5648373-A CoA-IT and PAF inhibitors SMITHKLINE BEECHAM CORPORATION (US) 1997-07-15 US disclosed
EP-0626969-A4 CoA-IT AND PAF INHIBITORS. SMITHKLINE BEECHAM CORP (US) 1995-04-19 EP disclosed
EP-0626969-A1 CoA-IT AND PAF INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 1994-12-07 EP disclosed
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
WO-1993016674-A1 CoA-IT AND PAF INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 1993-09-02 WO disclosed
EP-0359197-B1 ANTIHYPERCHOLESTEROLEMIC 4,5-DIARYL-2-SUBSTITUTED THIOIMIDAZOLES THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1992-12-23 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
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