SCHEMBL10242287

SCHEMBL10242287

C[C@@H]1NC(=O)O[C@@H]1c1cc(F)c(F)c(F)c1

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 19/20 0.39
PGR P06401 1/20 0.35
KCNH2 Q12809 1/20 0.35

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
SCHEMBL532340 0.84 GRM5 (0.50) GRM5
SCHEMBL1644168 0.84 GRM5 (0.50) GRM5
SCHEMBL531357 0.84 GRM5 (0.50) GRM5
SCHEMBL1643910 0.84 GRM5 (0.50) GRM5
SCHEMBL7654253 0.83 GRM5 (0.54) GRM5PGRKCNH2
SCHEMBL7655582 0.83 GRM5 (0.54) GRM5PGRKCNH2
SCHEMBL10242113 0.83 GRM5 (0.54) GRM5PGRKCNH2
SCHEMBL7654264 0.83 GRM5 (0.54) GRM5PGRKCNH2
SCHEMBL10242859 0.79 GRM5 (0.43) GRM5PGRKCNH2
SCHEMBL1529100 0.79 GRM5 (0.39) GRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2632269-B1 CYCLIC AMINE SUBSTITUTED OXAZOLIDINONES AS CETP INHIBITORS MERCK SHARP & DOHME (US) 2017-03-15 EP disclosed
US-9221834-B2 Cyclic amine substituted oxazolidinone CETP inhibitor MERCK SHARP & DOHME CORP. (US) 2015-12-29 US disclosed
US-20140221383-A1 CETP INHIBITORS MERCK SHARP & DOHME CORP. (US) 2014-08-07 US disclosed
US-20140221383-A1 CETP INHIBITORS MERCK SHARP & DOHME CORP. (US) 2014-08-07 US disclosed
EP-1765793-B1 ANACETRAPIB AND OTHER CETP INHIBITPRS MERCK SHARP & DOHME (US) 2012-09-26 EP disclosed
EP-2415759-A1 CETP inhibitors Merck Sharp & Dohme Corporation (US) 2012-02-08 EP disclosed
US-20080119476-A1 Cetp Inhibitors ALI AMJAD 2008-05-22 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 (2 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-20140221383-A1 CETP INHIBITORS CETP, APOB, MTTP GRM5 4799/4885PGR 995/4885KCNH2 2563/4885
US-20080119476-A1 Cetp Inhibitors CETP, APOB, MTTP GRM5 4799/4885PGR 995/4885KCNH2 2563/4885

“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.