SCHEMBL5669136

SCHEMBL5669136

CCCCN(CC)c1cc2c(cc1CN(Cc1cc(C#N)cc(C(F)(F)F)c1)C(=O)O)CCC2

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CETP P11597 2/20 0.34
CYP3A4 P08684 1/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
RXRA P19793 1/20 0.33
RXRG P48443 1/20 0.33
PTGES O14684 3/20 0.32
GPBAR1 Q8TDU6 2/20 0.31
KCNH2 Q12809 1/20 0.31
MRGPRX4 Q96LA9 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
SCHEMBL5148351 0.91 CYP3A4 (0.38) CETPCYP3A4MAPTMAPK1GPBAR1
SCHEMBL1901560 0.91 CETP (0.43) CETP
SCHEMBL5668906 0.88 CYP3A4 (0.35) CETPCYP3A4MAPTMAPK1GPBAR1
SCHEMBL5670396 0.87 CYP3A4 (0.35) CETPCYP3A4MAPTMAPK1GPBAR1
SCHEMBL5148388 0.87 NR1H2 (0.38) CETPCYP3A4MAPTMAPK1GPBAR1
SCHEMBL2797276 0.87 CETP (0.34) CETPRXRARXRGPTGESGPBAR1
SCHEMBL16279276 0.86 GPBAR1 (0.36) CETPCYP3A4MAPTMAPK1GPBAR1
SCHEMBL16279737 0.86 GPBAR1 (0.38) CETPGPBAR1
SCHEMBL5670517 0.86 KCNH2 (0.38) CETPCYP3A4MAPTMAPK1RXRA
SCHEMBL5671315 0.84 CYP3A4 (0.43) CETPCYP3A4MAPTMAPK1GPBAR1

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 1/4885CYP3A4 1980/4885MAPT 4475/4885

“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.