SCHEMBL7126717

SCHEMBL7126717

COc1cccc(C(=O)Nc2ccccc2Oc2ccc(C(=O)O)c(C(=O)O)c2)c1OC

nearest known ligand 0.70

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PYGM P11217 10/20 0.70
PYGL P06737 9/20 0.69
KMT2A Q03164 2/20 0.62
RAB9A P51151 4/20 0.58
LMNA P02545 2/20 0.58
MEN1 O00255 1/20 0.56
KDM4E B2RXH2 2/20 0.55
ALDH1A1 P00352 2/20 0.55
GAA P10253 1/20 0.55
NPC1 O15118 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
TP53 P04637 1/20 0.54
NPSR1 Q6W5P4 1/20 0.53
MAPT P10636 1/20 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
SCHEMBL7129418 0.91 PYGL (0.74) PYGMPYGLKMT2ARAB9ALMNA
SCHEMBL7123098 0.87 PYGL (0.83) PYGMPYGLKMT2ARAB9ALMNA
SCHEMBL7125571 0.87 PYGM (0.73) PYGMPYGLKMT2ARAB9ALMNA
SCHEMBL7116632 0.86 PYGM (0.76) PYGMPYGLKMT2ARAB9ALMNA
SCHEMBL7118256 0.84 PYGL (0.74) PYGMPYGLKMT2ARAB9ALMNA
SCHEMBL7126661 0.83 PYGM (0.81) PYGMPYGLKMT2ARAB9ALMNA
SCHEMBL7125504 0.83 PYGM (0.64) PYGMPYGLKMT2ARAB9ALMNA
SCHEMBL7125728 0.83 PYGM (0.69) PYGMPYGLKMT2ARAB9ALMNA
SCHEMBL7123047 0.82 PYGL (0.76) PYGMPYGLKMT2ARAB9ALMNA
SCHEMBL6431378 0.82 PYGM (1.00) PYGMPYGLKMT2ARAB9AMEN1

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-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

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 1/4885KMT2A 971/4885

“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.