SCHEMBL7128541

SCHEMBL7128541

CC(C)(C)c1ccc(C(=O)Nc2ccccc2Oc2ccc(C(=O)O)c(C(=O)O)c2)cc1

nearest known ligand 0.69

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PYGM P11217 10/20 0.69
PYGL P06737 10/20 0.66
HPSE Q9Y251 1/20 0.57
TDP1 Q9NUW8 2/20 0.55
DUSP3 P51452 1/20 0.55
PTPN5 P54829 1/20 0.55
PTPN11 Q06124 1/20 0.55
GALK1 P51570 1/20 0.55
CASP6 P55212 1/20 0.55
MCL1 Q07820 1/20 0.55
PLEC Q15149 1/20 0.55
PPARG P37231 4/20 0.54
NR1H4 Q96RI1 3/20 0.54
PPARA Q07869 2/20 0.54
LMNA P02545 1/20 0.53
RAB9A P51151 1/20 0.53

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
SCHEMBL6431208 0.89 PYGL (0.80) PYGMPYGLHPSETDP1GALK1
SCHEMBL7126723 0.89 PYGL (0.66) PYGMPYGLHPSETDP1GALK1
SCHEMBL7126611 0.88 PYGM (0.72) PYGMPYGLHPSETDP1GALK1
SCHEMBL7126661 0.88 PYGM (0.81) PYGMPYGLHPSETDP1GALK1
SCHEMBL7128870 0.87 PYGL (0.70) PYGMPYGLHPSETDP1GALK1
SCHEMBL6431898 0.87 PYGM (0.70) PYGMPYGLHPSETDP1GALK1
SCHEMBL7125502 0.86 PYGM (0.79) PYGMPYGLHPSETDP1GALK1
SCHEMBL7122252 0.86 PYGL (0.69) PYGMPYGLHPSETDP1GALK1
SCHEMBL7117307 0.85 RAB9A (0.69) PYGMPYGLHPSETDP1GALK1
SCHEMBL7125068 0.85 PYGM (0.71) PYGMPYGLHPSETDP1DUSP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030186944-A1 Such as 4-(2-(3-dimethylaminobenzoylamino)phenoxy)phthalic acid for treatment/prevention of diabetes; for inhibiting liver glycogen phosphorylase; dietetics KRISTIANSEN MARIT (DK) 2003-10-02 US disclosed
US-6590118-B1 Used in treatment of and/or prevention of diabetes, especially non-insulin dependent diabetes (Type 2 diabetes) NOVO NORDISK A/S (DK) 2003-07-08 US disclosed
EP-1220832-A1 NOVEL AROMATIC COMPOUNDS NOVO NORDISK A/S (DK) 2002-07-10 EP disclosed
WO-2001023347-A1 NOVEL AROMATIC COMPOUNDS NOVO NORDISK A/S (DK) 2001-04-05 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-20030186944-A1 Such as 4-(2-(3-dimethylaminobenzoylamino)phenoxy)phthalic acid for treatment/prevention of diabetes; for inhibiting liver glycogen phosphorylase; dietetics PYGL, GYS2, PYGM PYGM 3/4885PYGL 1/4885HPSE 1031/4885

“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.