SCHEMBL9946558

SCHEMBL9946558

CC(C)N1C(=O)O[C@H](c2cc(Cl)cc(Cl)c2)C[C@H]1C

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MDM2 Q00987 6/20 0.36
▸ TTR P02766 1/20 0.35
▸ TP53 P04637 2/20 0.32
▸ HTR6 P50406 1/20 0.31
▸ FADS1 O60427 1/20 0.31
▸ PGR P06401 1/20 0.30

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
SCHEMBL13950180 1.00 MDM2 (0.36) MDM2TTRTP53HTR6FADS1
SCHEMBL13950179 1.00 MDM2 (0.36) MDM2TTRTP53HTR6FADS1
SCHEMBL9946536 0.82 TTR (0.37) MDM2TTRHTR6FADS1
SCHEMBL16181049 0.82 TTR (0.37) MDM2TTRHTR6FADS1
SCHEMBL13970600 0.82 TTR (0.37) MDM2TTRHTR6FADS1
SCHEMBL20794167 0.76 FADS1 (0.38) MDM2TTRTP53FADS1
SCHEMBL22222475 0.76 FADS1 (0.38) MDM2TTRTP53FADS1
SCHEMBL13547561 0.76 FADS1 (0.38) MDM2TTRTP53FADS1
SCHEMBL13950175 0.72 HSD11B1 (0.36) MDM2TTRHTR6FADS1
SCHEMBL13950182 0.71 HTR2C (0.34) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8865707-B2 Cholesteryl ester transfer protein inhibitors MERCK SHARP & DOHME CORP. (US) 2014-10-21 — — US disclosed
EP-1973546-B1 CHOLESTERYL ESTER TRANSFER PROTEIN INHIBITORS MERCK SHARP & DOHME (US) 2012-06-13 — — EP disclosed
US-20090018054-A1 Cholesteryl Ester Transfer Protein Inhibitors MERCK SHARP & DOHME LLC 2009-01-15 — — US disclosed
US-20090018054-A1 Cholesteryl Ester Transfer Protein Inhibitors MERCK SHARP & DOHME LLC 2009-01-15 — — 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 (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-20090018054-A1 Cholesteryl Ester Transfer Protein Inhibitors CETP, APOB, MTTP MDM2 4647/4885TTR 593/4885TP53 4657/4885

“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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