SCHEMBL4075748

SCHEMBL4075748

CCCCCS(=O)(=O)/C(C#N)=C/c1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.51
CYP3A4 P08684 3/20 0.51
MAPT P10636 3/20 0.51
TSHR P16473 3/20 0.51
BLM P54132 3/20 0.51
KMT2A Q03164 3/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
HSD17B10 Q99714 3/20 0.51
CYP1A2 P05177 3/20 0.51
CYP2C9 P11712 3/20 0.51
RGS12 O14924 2/20 0.51
GMNN O75496 2/20 0.51
ALDH1A1 P00352 2/20 0.51
LMNA P02545 2/20 0.51
TP53 P04637 2/20 0.51
HPGD P15428 2/20 0.51
ALOX15 P16050 2/20 0.51
NFKB1 P19838 2/20 0.51
CYP2C19 P33261 2/20 0.51
THPO P40225 2/20 0.51

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
SCHEMBL4075749 1.00 MEN1 (0.51) MEN1CYP3A4MAPTTSHRBLM
SCHEMBL4075752 1.00 MEN1 (0.51) MEN1CYP3A4MAPTTSHRBLM
SCHEMBL4069988 0.99 MEN1 (0.50) MEN1CYP3A4MAPTTSHRBLM
SCHEMBL4069993 0.99 MEN1 (0.50) MEN1CYP3A4MAPTTSHRBLM
SCHEMBL17407586 0.99 MEN1 (0.50) MEN1CYP3A4MAPTTSHRBLM
SCHEMBL4072506 0.99 MEN1 (0.50) MEN1CYP3A4MAPTTSHRBLM
SCHEMBL3250045 0.99 MEN1 (0.50) MEN1CYP3A4MAPTTSHRBLM
SCHEMBL4069985 0.99 MEN1 (0.50) MEN1CYP3A4MAPTTSHRBLM
SCHEMBL3250042 0.99 MEN1 (0.50) MEN1CYP3A4MAPTTSHRBLM
SCHEMBL4072513 0.99 MEN1 (0.50) MEN1CYP3A4MAPTTSHRBLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1625112-B1 NOVEL COMPOUNDS FOR TREATMENT OF OBESITY HIGH POINT PHARMACEUTICALS LLC (US) 2009-07-22 EP claimed
JP-2007503453-A 2007-02-22 JP claimed
US-20060128662-A1 Novel compounds for treatment of obesity NOVO NORDISK A/S (DK) 2006-06-15 US claimed
EP-1625112-A1 NOVEL COMPOUNDS FOR TREATMENT OF OBESITY NOVO NORDISK A/S (DK) 2006-02-15 EP claimed
WO-2004101505-A1 NOVEL COMPOUNDS FOR TREATMENT OF OBESITY NOVO NORDISK A/S (DK) 2004-11-25 WO claimed
EP-1625112-B1 NOVEL COMPOUNDS FOR TREATMENT OF OBESITY HIGH POINT PHARMACEUTICALS LLC (US) 2009-07-22 EP disclosed
US-20060128662-A1 Novel compounds for treatment of obesity NOVO NORDISK A/S (DK) 2006-06-15 US disclosed
EP-1625112-A1 NOVEL COMPOUNDS FOR TREATMENT OF OBESITY NOVO NORDISK A/S (DK) 2006-02-15 EP disclosed
WO-2004101505-A1 NOVEL COMPOUNDS FOR TREATMENT OF OBESITY NOVO NORDISK A/S (DK) 2004-11-25 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-20060128662-A1 Novel compounds for treatment of obesity GPR119, FABP4, HSD17B4 MEN1 4794/4885CYP3A4 353/4885MAPT 4680/4885

“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.