SCHEMBL7129478

SCHEMBL7129478

O=C(Nc1ccccc1Oc1ccc(C(=O)O)c(C(=O)O)c1)c1ccc2ccccc2c1

nearest known ligand 0.72

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PYGL P06737 13/20 0.72
PYGM P11217 12/20 0.72
NPC1 O15118 1/20 0.58
RAB9A P51151 1/20 0.58
HPSE Q9Y251 1/20 0.56
GALK1 P51570 1/20 0.54
CASP6 P55212 1/20 0.54
MCL1 Q07820 1/20 0.54
PLEC Q15149 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
DHODH Q02127 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) PYGLPYGMHPSEGALK1CASP6
SCHEMBL7128870 0.87 PYGL (0.70) PYGLPYGMRAB9AHPSEGALK1
SCHEMBL6431898 0.87 PYGM (0.70) PYGLPYGMHPSEGALK1CASP6
SCHEMBL7119403 0.86 PYGM (0.76) PYGLPYGMNPC1RAB9AHPSE
SCHEMBL7125719 0.86 PYGM (0.72) PYGLPYGMHPSETDP1
SCHEMBL7128543 0.86 PYGM (0.72) PYGLPYGMRAB9AHPSETDP1
SCHEMBL7125502 0.86 PYGM (0.79) PYGLPYGMNPC1RAB9AHPSE
SCHEMBL7122252 0.86 PYGL (0.69) PYGLPYGMRAB9AHPSEGALK1
SCHEMBL7126611 0.86 PYGM (0.72) PYGLPYGMRAB9AHPSEGALK1
SCHEMBL7126661 0.86 PYGM (0.81) PYGLPYGMRAB9AHPSEGALK1

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 PYGL 1/4885PYGM 3/4885NPC1 3024/4885

“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.