SCHEMBL5669609

SCHEMBL5669609

CCN(CC1CCCC1)c1cc2c(cc1CN(Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)C(=O)O)CCC2

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CETP P11597 4/20 0.37
TACR1 P25103 1/20 0.33
TP53 P04637 1/20 0.32
HTT P42858 1/20 0.32
PTGDR2 Q9Y5Y4 1/20 0.31
CYP3A4 P08684 1/20 0.30
MAPT P10636 1/20 0.30
MAPK1 P28482 1/20 0.30
GPBAR1 Q8TDU6 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
SCHEMBL5670981 1.00 CETP (0.37) CETPTACR1TP53HTTPTGDR2
SCHEMBL1898379 0.92 CETP (0.45) CETPPTGDR2
SCHEMBL5669504 0.91 CETP (0.37) CETPTACR1PTGDR2GPBAR1
SCHEMBL16279786 0.87 CYP3A4 (0.43) CETPTP53HTTCYP3A4MAPT
SCHEMBL5671315 0.87 CYP3A4 (0.43) CETPTP53HTTCYP3A4MAPT
SCHEMBL5670198 0.86 CYP3A4 (0.33) CYP3A4MAPTMAPK1
SCHEMBL5150109 0.85 CETP (0.35) CETPTACR1
SCHEMBL2797276 0.85 CETP (0.34) CETPTACR1PTGDR2GPBAR1
SCHEMBL1898493 0.83 CETP (0.47) CETP
SCHEMBL1896945 0.79 CETP (0.45) CETPCYP3A4MAPTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1670446-A2 METHOD OF INHIBITING REMNANT LIPOPROTEIN PRODUCTION JAPAN TOBACCO INC. (JP) 2006-06-21 EP claimed
WO-2005030185-A2 METHOD OF INHIBITING REMNANT LIPOPROTEIN PRODUCTION JAPAN TOBACCO INC. (JP) 2005-04-07 WO claimed
US-20140364493-A1 METHOD OF INHIBITING REMNANT LIPOPROTEIN PRODUCTION JAPAN TOBACCO INC. (JP) 2014-12-11 US disclosed
EP-1670446-A2 METHOD OF INHIBITING REMNANT LIPOPROTEIN PRODUCTION JAPAN TOBACCO INC. (JP) 2006-06-21 EP disclosed
WO-2005030185-A2 METHOD OF INHIBITING REMNANT LIPOPROTEIN PRODUCTION JAPAN TOBACCO INC. (JP) 2005-04-07 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-20140364493-A1 METHOD OF INHIBITING REMNANT LIPOPROTEIN PRODUCTION CETP, PCSK9, LIPA CETP 1/4885TACR1 1329/4885TP53 4711/4885

“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.