SCHEMBL12153159

SCHEMBL12153159

Cc1ccccc1OCC(=O)Nc1ccc(-c2nc3cc(C#N)cnc3o2)cc1

nearest known ligand 0.77

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CEPT1 Q9Y6K0 17/20 0.77
CETP P11597 6/20 0.77
MAPT P10636 1/20 0.65
RXFP1 Q9HBX9 1/20 0.65

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
SCHEMBL20768087 0.87 CEPT1 (1.00) CEPT1CETPMAPT
SCHEMBL1736075 0.87 CEPT1 (1.00) CEPT1CETPMAPTRXFP1
SCHEMBL1733985 0.86 CETP (0.75) CEPT1CETPMAPTRXFP1
SCHEMBL20768005 0.82 CEPT1 (1.00) CEPT1CETP
SCHEMBL1733898 0.80 CEPT1 (1.00) CEPT1CETPMAPTRXFP1
SCHEMBL1733919 0.80 CEPT1 (1.00) CEPT1CETPMAPTRXFP1
SCHEMBL1734901 0.78 CEPT1 (0.81) CEPT1CETPMAPT
SCHEMBL13676939 0.78 CEPT1 (0.81) CEPT1CETPMAPTRXFP1
SCHEMBL20768089 0.78 CETP (1.00) CEPT1CETPMAPT
SCHEMBL1736218 0.78 CEPT1 (1.00) CEPT1CETPMAPTRXFP1

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-1954287-B2 CETP INHIBITORS MERCK SHARP & DOHME (US) 2016-02-24 EP disclosed
US-8334290-B2 CETP inhibitors MERCK SHARP & DOHME CORP. (US) 2012-12-18 US disclosed
EP-1954287-B1 CETP INHIBITORS MERCK SHARP & DOHME (US) 2011-11-16 EP disclosed
US-20090264405-A1 Cetp Inhibitors MERCK SHARP & DOHME LLC 2009-10-22 US disclosed
WO-2007070173-A2 CETP INHIBITORS MERCK & CO., INC. (US) 2007-06-21 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090264405-A1 Cetp Inhibitors CETP, APOB, PCSK9 CEPT1 91/4885CETP 1/4885MAPT 1796/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.