SCHEMBL6304142

SCHEMBL6304142

CCc1cc(Oc2cccc(N(Cc3ccccc3SC(F)(F)F)C(CO)c3ccccc3C(F)(F)F)c2)ccc1Cl

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CETP P11597 11/20 0.45
NR1H2 P55055 3/20 0.33
NR1H3 Q13133 3/20 0.33
AR P10275 1/20 0.32
FFAR4 Q5NUL3 4/20 0.32
FFAR1 O14842 2/20 0.32
RAF1 P04049 1/20 0.31

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
SCHEMBL6305022 0.89 CETP (0.40) CETP
SCHEMBL6307733 0.87 CETP (0.49) CETPNR1H2NR1H3AR
SCHEMBL6304082 0.86 CETP (0.40) CETPNR1H2NR1H3ARFFAR4
SCHEMBL6304269 0.85 CETP (0.38) CETPNR1H2NR1H3FFAR4FFAR1
SCHEMBL6305094 0.85 CETP (0.39) CETP
SCHEMBL6304765 0.85 CETP (0.63) CETPNR1H2NR1H3
SCHEMBL6304248 0.85 CETP (0.55) CETP
SCHEMBL6305339 0.84 CETP (0.64) CETPNR1H2NR1H3
SCHEMBL6311205 0.82 CETP (0.63) CETPNR1H2NR1H3
SCHEMBL6305342 0.82 CETP (0.63) CETP

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.