SCHEMBL12153109

SCHEMBL12153109

CC(C)N1CCC2(CC1)CN(S(=O)(=O)C(F)(F)F)c1ccccc12

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ P2RY1 P47900 2/20 0.46
▸ NPY5R Q15761 17/20 0.41
▸ TACR1 P25103 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
SCHEMBL13677346 0.86 P2RY1 (0.44) P2RY1NPY5R
SCHEMBL12153150 0.85 NPY5R (0.55) NPY5RTACR1
SCHEMBL17538381 0.83 NPY5R (0.43) NPY5RTACR1
SCHEMBL13209381 0.74 P2RY1 (0.46) P2RY1
SCHEMBL13676986 0.72 NOTUM (0.74) P2RY1
SCHEMBL6026997 0.70 NPY5R (0.58) NPY5RTACR1
SCHEMBL30425441 0.70 NOTUM (0.60) NPY5R
SCHEMBL14193183 0.68 CYP2D6 (0.45) P2RY1
SCHEMBL14242298 0.68 NPY5R (0.56) NPY5RTACR1
SCHEMBL16861146 0.68 NOTUM (0.48) NPY5R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8334290-B2 CETP inhibitors MERCK SHARP & DOHME CORP. (US) 2012-12-18 — — US 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
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 P2RY1 4126/4885NPY5R 3939/4885TACR1 3263/4885

“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.

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