SCHEMBL5670517

SCHEMBL5670517

CCCCN(CC)c1cc2ccccc2cc1CN(Cc1cc(C#N)cc(C(F)(F)F)c1)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 2/20 0.38
GPBAR1 Q8TDU6 4/20 0.37
PTGES O14684 3/20 0.36
CETP P11597 1/20 0.36
RXRA P19793 1/20 0.35
RXRG P48443 1/20 0.35
TACR1 P25103 1/20 0.35
CTSK P43235 1/20 0.35
NR1H2 P55055 1/20 0.35
NR1H3 Q13133 1/20 0.35
LMNA P02545 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CYP3A4 P08684 1/20 0.34
MAPT P10636 1/20 0.34
MAPK1 P28482 1/20 0.34
TAS2R14 Q9NYV8 1/20 0.34
CNR2 P34972 1/20 0.34

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
SCHEMBL1899458 0.91 CETP (0.46) CETP
SCHEMBL5671071 0.87 NR1H2 (0.41) CETPRXRARXRGNR1H2NR1H3
SCHEMBL5669136 0.86 CETP (0.34) KCNH2GPBAR1PTGESCETPRXRA
SCHEMBL2264290 0.83 GPBAR1 (0.35) KCNH2GPBAR1PTGESRXRARXRG
SCHEMBL1899328 0.80 CETP (0.45) CETPNR1H2NR1H3
SCHEMBL5148374 0.77 SERPINE1 (0.39) CETPRXRARXRGNR1H2NR1H3
SCHEMBL1901560 0.77 CETP (0.43) CETP
SCHEMBL5148351 0.76 CYP3A4 (0.38) GPBAR1CETPTACR1CYP3A4MAPT
SCHEMBL16279691 0.74 CYP3A4 (0.36) GPBAR1CETPTACR1CYP3A4MAPT
SCHEMBL5668906 0.73 CYP3A4 (0.35) GPBAR1CETPTACR1NR1H2NR1H3

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 KCNH2 4388/4885GPBAR1 329/4885PTGES 1900/4885

“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.