SCHEMBL6311685

SCHEMBL6311685

CC(C)c1cccc(Oc2cccc(N(Cc3cc(C(F)(F)F)ccc3F)C(CO)c3ccc(C(F)(F)F)cc3)c2)c1

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CETP P11597 14/20 0.47
NR1H2 P55055 3/20 0.35
NR1H3 Q13133 3/20 0.35
PPARG P37231 1/20 0.34
FFAR1 O14842 1/20 0.33

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
SCHEMBL6304746 0.94 CETP (0.47) CETPNR1H2NR1H3PPARGFFAR1
SCHEMBL6304914 0.94 CETP (0.47) CETPNR1H2NR1H3PPARGFFAR1
SCHEMBL6304748 0.89 CETP (0.44) CETPPPARGFFAR1
SCHEMBL6312123 0.88 CETP (0.50) CETP
SCHEMBL6307713 0.88 CETP (0.47) CETPNR1H2NR1H3PPARG
SCHEMBL6304215 0.88 CETP (0.51) CETP
SCHEMBL6311890 0.85 CETP (0.67) CETPNR1H2NR1H3PPARG
SCHEMBL7081939 0.84 CETP (0.49) CETP
SCHEMBL6306916 0.83 CETP (0.46) CETP
SCHEMBL6311233 0.83 CETP (0.45) CETPNR1H2NR1H3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6861561-B2 Substituted aromatic policyclic tertiary-heteroalkylamines useful for inhibiting cholesteryl ester transfer protein activity G. D. SEARLE & CO. (US) 2005-03-01 US claimed
US-20030225088-A1 Substituted aromatic policyclic tertiary-heteroalkylamines useful for inhibiting cholesteryl ester transfer protein activity G.D. SEARLE & CO. (US) 2003-12-04 US claimed
US-6482862-B1 Method of using substituted N-benzyl-N-phenyl aminoalcohols for inhibiting cholesteryl ester transfer protein activity G.D. SEARLE & CO. 2002-11-19 US claimed

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-20030225088-A1 Substituted aromatic policyclic tertiary-heteroalkylamines useful for inhibiting cholesteryl ester transfer protein activity CETP, PCTP, MTTP CETP 1/4885NR1H2 188/4885NR1H3 204/4885

“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.