SCHEMBL7128543

SCHEMBL7128543

Cc1ccc(C(=O)Nc2ccccc2Oc2ccc(C(=O)O)c(C(=O)O)c2)cc1C

nearest known ligand 0.72

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PYGM P11217 10/20 0.72
PYGL P06737 13/20 0.69
TDP1 Q9NUW8 2/20 0.68
CYP1A2 P05177 1/20 0.57
CYP2C9 P11712 1/20 0.57
CYP2C19 P33261 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
NPSR1 Q6W5P4 1/20 0.57
HPSE Q9Y251 1/20 0.54
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
LMNA P02545 1/20 0.53
MAPT P10636 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
SCHEMBL7126611 0.88 PYGM (0.72) PYGMPYGLTDP1HPSELMNA
SCHEMBL7128870 0.87 PYGL (0.70) PYGMPYGLTDP1HPSELMNA
SCHEMBL6431208 0.87 PYGL (0.80) PYGMPYGLTDP1HPSE
SCHEMBL7128950 0.87 CYP1A2 (0.79) PYGMPYGLCYP1A2CYP2C9CYP2C19
SCHEMBL6432020 0.86 PYGM (0.80) PYGMPYGLMEN1KMT2A
SCHEMBL7116980 0.86 PYGM (0.72) PYGMPYGLTDP1HPSELMNA
SCHEMBL7126661 0.86 PYGM (0.81) PYGMPYGLTDP1NPSR1HPSE
SCHEMBL7129478 0.86 PYGL (0.72) PYGMPYGLTDP1HPSERAB9A
SCHEMBL6431898 0.85 PYGM (0.70) PYGMPYGLTDP1SMN1; SMN2HPSE
SCHEMBL7119403 0.84 PYGM (0.76) PYGMPYGLTDP1HPSEMEN1

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 1/4885TDP1 1738/4885

“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.