SCHEMBL7124136

SCHEMBL7124136

CCOP(=O)(OCC)c1ccc(Oc2ccccc2NC(=O)c2cccc([N+](=O)[O-])c2)cc1

nearest known ligand 0.71

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.71
PYGL P06737 11/20 0.63
PYGM P11217 2/20 0.63
NPSR1 Q6W5P4 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
CYP1A2 P05177 1/20 0.54
CYP2C9 P11712 1/20 0.54
CYP2C19 P33261 1/20 0.54
ALDH1A1 P00352 4/20 0.52
LMNA P02545 2/20 0.52
HSP90AA1 P07900 1/20 0.52
GAA P10253 1/20 0.51
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
TDP1 Q9NUW8 1/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49

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
SCHEMBL7126623 0.92 MAPT (0.70) MAPTPYGLPYGMNPSR1SMN1; SMN2
SCHEMBL7124027 0.87 MAPT (0.81) MAPTPYGLPYGMNPSR1SMN1; SMN2
SCHEMBL7124140 0.83 MAPT (0.65) MAPTPYGLPYGMNPSR1SMN1; SMN2
SCHEMBL27716705 0.82 MAPT (0.87) MAPTPYGLPYGMNPSR1SMN1; SMN2
SCHEMBL7129453 0.80 MAPT (0.80) MAPTPYGLPYGMNPSR1SMN1; SMN2
SCHEMBL6431794 0.78 PYGL (0.81) MAPTPYGLPYGM
SCHEMBL7122317 0.78 MAPT (0.76) MAPTPYGLPYGMNPSR1SMN1; SMN2
SCHEMBL7126028 0.78 MAPT (0.83) MAPTPYGLPYGMNPSR1SMN1; SMN2
SCHEMBL7122319 0.78 MAPT (0.68) MAPTPYGLPYGMNPSR1SMN1; SMN2
SCHEMBL6431792 0.78 PYGL (0.78) MAPTPYGLPYGMMEN1KMT2A

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 MAPT 2042/4885PYGL 1/4885PYGM 3/4885

“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.