SCHEMBL13619654

SCHEMBL13619654

O=CCCC(O)c1ccc(F)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 1/20 0.44
SIGMAR1 Q99720 2/20 0.41
KDM4E B2RXH2 2/20 0.41
CYP1A2 P05177 1/20 0.41
GAA P10253 1/20 0.41
CYP2C9 P11712 1/20 0.41
DRD2 P14416 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
GABBR2 O75899 1/20 0.39
GABBR1 Q9UBS5 1/20 0.39
SLC6A3 Q01959 3/20 0.38
SLC6A4 P31645 2/20 0.38
ABCB11 O95342 1/20 0.38
LMNA P02545 1/20 0.38
PGR P06401 1/20 0.38
CYP3A4 P08684 1/20 0.38
ADORA3 P0DMS8 1/20 0.38
CHRM1 P11229 1/20 0.38
DRD1 P21728 1/20 0.38

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
SCHEMBL1831612 0.81 AOC3 (0.44) AOC3SIGMAR1KDM4ECYP1A2GAA
SCHEMBL31378985 0.80 AOC3 (0.47) AOC3SIGMAR1KDM4ECYP1A2GAA
SCHEMBL634044 0.80 KDM4E (0.52) AOC3KDM4ECYP1A2CYP2C9LMNA
SCHEMBL67251 0.80 CYP19A1 (0.41) MEN1KMT2ALMNANPSR1
SCHEMBL26109029 0.77 IDO1 (0.32) MEN1KMT2AGABBR2GABBR1SLC6A3
SCHEMBL6223969 0.77 IDO1 (0.32) MEN1KMT2AGABBR2GABBR1SLC6A3
SCHEMBL5586175 0.77 IDO1 (0.32) MEN1KMT2AGABBR2GABBR1SLC6A3
SCHEMBL26106019 0.77 IDO1 (0.32) AOC3MEN1KMT2AGABBR2GABBR1
SCHEMBL27999842 0.77 HTT (0.37) AOC3KDM4EMEN1KMT2ALMNA
SCHEMBL22105007 0.77 AOC3 (0.45) AOC3SIGMAR1KDM4ECYP1A2GAA

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-20090275524-A1 NOVEL HYPOCHOLESTEROLEMIC COMPOUNDS LIPIDEON BIOTECHNOLOGY AG 2009-11-05 US disclosed
US-7544667-B2 Hypocholesterolemic compounds LIPIDEON BIOTECHNOLOGY AG (CH) 2009-06-09 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 (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-20090275524-A1 NOVEL HYPOCHOLESTEROLEMIC COMPOUNDS CYP46A1, SREBF1, CETP AOC3 2808/4885SIGMAR1 2481/4885KDM4E 4529/4885

“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.