SCHEMBL1506468

SCHEMBL1506468

O=C1C=Cc2s[c]cc2C1

nearest known ligand 0.40

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GSK3A P49840 1/20 0.40
GSK3B P49841 1/20 0.40

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
SCHEMBL277815 0.61
SCHEMBL366153 0.57 GSK3A (0.71) GSK3AGSK3B
SCHEMBL6230840 0.56 GSK3A (0.50) GSK3AGSK3B
SCHEMBL15914282 0.55 GSK3A (0.42) GSK3AGSK3B
SCHEMBL28510714 0.55 GSK3A (0.48) GSK3AGSK3B
SCHEMBL5479958 0.55 GSK3A (0.48) GSK3AGSK3B
SCHEMBL5468613 0.54 GSK3A (0.40) GSK3AGSK3B
SCHEMBL29421729 0.54 GSK3A (0.46) GSK3AGSK3B
SCHEMBL7684528 0.53
SCHEMBL3106328 0.52 GSK3A (0.43) GSK3AGSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140221383-A1 CETP INHIBITORS MERCK SHARP & DOHME CORP. (US) 2014-08-07 US claimed
US-7910592-B2 CETP inhibitors MERCK SHARP & DOHME CORP. (US) 2011-03-22 US claimed
US-20100099716-A1 CETP INHIBITORS MERCK SHARP & DOHME LLC 2010-04-22 US claimed
US-20090042892-A1 Cetp Inhibitors MERCK SHARP & DOHME LLC 2009-02-12 US claimed
US-20080119476-A1 Cetp Inhibitors ALI AMJAD 2008-05-22 US claimed
US-20060040999-A1 CETP inhibitors MERCK SHARP & DOHME LLC 2006-02-23 US claimed
US-20140221383-A1 CETP INHIBITORS MERCK SHARP & DOHME CORP. (US) 2014-08-07 US disclosed
US-8735435-B2 CETP inhibitors MERCK SHARP & DOHME CORP. (US) 2014-05-27 US disclosed
US-7910592-B2 CETP inhibitors MERCK SHARP & DOHME CORP. (US) 2011-03-22 US disclosed
US-20100099716-A1 CETP INHIBITORS MERCK SHARP & DOHME LLC 2010-04-22 US disclosed
US-7652049-B2 1-benzyl-4-[4'-fluoro-5'-isopropyl-2'-methoxy-4-(trifluoromethyl)biphenyl-2-yl]imidazolidin-2-one; cholesteryl ester transfer protein inhibitor; raising HDL-cholesterol, reducing LDL-cholesterol; atherosclerosis; antiinflammatory agent; synergistic mixture with other active ingredients MERCK & CO., INC. (US) 2010-01-26 US disclosed
US-20090042892-A1 Cetp Inhibitors MERCK SHARP & DOHME LLC 2009-02-12 US disclosed
US-20060040999-A1 CETP inhibitors MERCK SHARP & DOHME LLC 2006-02-23 US 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 (5 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-20090042892-A1 Cetp Inhibitors CETP, APOB, MTTP GSK3A 1582/4885GSK3B 848/4885
US-20140221383-A1 CETP INHIBITORS CETP, APOB, MTTP GSK3A 3720/4885GSK3B 3127/4885
US-20060040999-A1 CETP inhibitors CETP, APOB, MTTP GSK3A 3720/4885GSK3B 3127/4885
US-20080119476-A1 Cetp Inhibitors CETP, APOB, MTTP GSK3A 3720/4885GSK3B 3127/4885
US-20100099716-A1 CETP INHIBITORS CETP, APOB, MTTP GSK3A 3720/4885GSK3B 3127/4885

“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.