SCHEMBL7076909

SCHEMBL7076909

OCC(c1cccc(C(F)(F)F)c1)N(Cc1cccc(SC(F)(F)F)c1)c1cccc(OCc2cccc(OC(F)(F)F)c2)c1

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CETP P11597 15/20 0.47
MRGPRX4 Q96LA9 1/20 0.38
NR4A2 P43354 1/20 0.38
MAOB P27338 1/20 0.37
SERPINE1 P05121 1/20 0.37

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
SCHEMBL6304745 0.94 CETP (0.47) CETPMRGPRX4NR4A2MAOB
SCHEMBL7084162 0.93 CETP (0.47) CETP
SCHEMBL6305090 0.91 CETP (0.49) CETPSERPINE1
SCHEMBL6388020 0.88 CETP (0.61) CETP
SCHEMBL6306920 0.88 CETP (0.46) CETPMRGPRX4NR4A2MAOB
SCHEMBL7081962 0.88 CETP (0.51) CETPMRGPRX4NR4A2MAOBSERPINE1
SCHEMBL6308686 0.86 CETP (0.49) CETP
SCHEMBL6306279 0.85 CETP (0.65) CETPNR4A2
SCHEMBL7080766 0.84 CETP (0.47) CETPMRGPRX4NR4A2MAOB
SCHEMBL6312395 0.84 CETP (0.47) CETPMRGPRX4NR4A2MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 1/4885MRGPRX4 3182/4885NR4A2 1830/4885

“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.