SCHEMBL2264883

SCHEMBL2264883

CCCN(CCC)c1cc2c(cc1CN(C(=O)O)C(C)c1cccc(C(=O)OC)c1)CCC2

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.40
CASR P41180 5/20 0.37
UBE2M P61081 2/20 0.36
DCUN1D1 Q96GG9 2/20 0.36
PPARG P37231 3/20 0.35
PPARA Q07869 3/20 0.35
NR3C1 P04150 1/20 0.33
ALDH1A1 P00352 2/20 0.33
CYP3A4 P08684 1/20 0.33
MAPK1 P28482 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
CHRM5 P08912 1/20 0.33
SLC7A5 Q01650 1/20 0.32

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
SCHEMBL2262702 0.86 CHRM5 (0.35) UBE2MDCUN1D1ALDH1A1CYP3A4MEN1
SCHEMBL1901365 0.77 LOXL2 (0.40) PARP1CASRNR3C1ALDH1A1SLC7A5
SCHEMBL1902763 0.72 DUSP3 (0.39) ALDH1A1
SCHEMBL16279837 0.69 PTGES (0.38) PPARGNR3C1ALDH1A1MEN1KMT2A
SCHEMBL5669028 0.69 PTGES (0.39) DCUN1D1NR3C1MEN1KMT2A
SCHEMBL5669271 0.68 CYP2D6 (0.46) ALDH1A1CYP3A4MAPK1MEN1KMT2A
SCHEMBL1899307 0.67 DUSP3 (0.37) PPARGPPARAALDH1A1MAPK1MEN1
SCHEMBL1902779 0.67 HTT (0.39) PPARGPPARAALDH1A1MAPK1
SCHEMBL2265549 0.66 CYP3A4 (0.33) UBE2MDCUN1D1CYP3A4MAPK1
SCHEMBL5669773 0.65 HCAR3 (0.40) ALDH1A1MEN1KMT2A

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
US-20070054839-A1 Method of inhibiting remnant lipoprotein production JAPAN TOBACCO INC. (JP) 2007-03-08 US claimed
US-20060270705-A1 Method for inhibiting lipid absorption and lipid absorption inhibitor JAPAN TOBACCO INC. (JP) 2006-11-30 US claimed
US-20110189210-A1 METHOD OF INHIBITING REMNANT LIPOPROTEIN PRODUCTION JAPAN TOBACCO INC. (JP) 2011-08-04 US disclosed
US-20070054839-A1 Method of inhibiting remnant lipoprotein production JAPAN TOBACCO INC. (JP) 2007-03-08 US disclosed
US-20060270705-A1 Method for inhibiting lipid absorption and lipid absorption inhibitor JAPAN TOBACCO INC. (JP) 2006-11-30 US 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 (3 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-20070054839-A1 Method of inhibiting remnant lipoprotein production CETP, PCSK9, LIPA PARP1 2137/4885CASR 4404/4885UBE2M 2671/4885
US-20110189210-A1 METHOD OF INHIBITING REMNANT LIPOPROTEIN PRODUCTION CETP, PCSK9, LIPA PARP1 2137/4885CASR 4404/4885UBE2M 2671/4885
US-20060270705-A1 Method for inhibiting lipid absorption and lipid absorption inhibitor CETP, SI, LIPC PARP1 3584/4885CASR 3524/4885UBE2M 3878/4885

“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.