SCHEMBL7116281

SCHEMBL7116281

COC(=O)c1ccc(Oc2ccccc2[N+](=O)[O-])cc1C(=O)OC

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.57
L3MBTL1 Q9Y468 1/20 0.51
ALDH1A1 P00352 4/20 0.51
HPGD P15428 2/20 0.49
NPSR1 Q6W5P4 1/20 0.49
SMN1; SMN2 Q16637 3/20 0.46
POLB P06746 3/20 0.45
MAPT P10636 2/20 0.45
RAB9A P51151 2/20 0.45
NPC1 O15118 1/20 0.45
KMT2A Q03164 1/20 0.45
F10 P00742 1/20 0.45
PYGL P06737 2/20 0.44
PYGM P11217 1/20 0.43
ESR2 Q92731 1/20 0.43

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
SCHEMBL5739859 0.85 L3MBTL1 (0.56) TDP1L3MBTL1ALDH1A1SMN1; SMN2POLB
SCHEMBL7125374 0.85 TDP1 (0.58) TDP1L3MBTL1ALDH1A1HPGDNPSR1
SCHEMBL1340946 0.85 L3MBTL1 (0.56) TDP1L3MBTL1ALDH1A1HPGDNPSR1
SCHEMBL10786894 0.83 TDP1 (0.65) TDP1L3MBTL1ALDH1A1HPGDNPSR1
SCHEMBL4606396 0.83 ALDH1A1 (0.59) TDP1L3MBTL1ALDH1A1SMN1; SMN2POLB
SCHEMBL1340930 0.82 MAPT (0.64) TDP1L3MBTL1ALDH1A1HPGDNPSR1
SCHEMBL8076951 0.82 L3MBTL1 (0.62) TDP1L3MBTL1ALDH1A1HPGDSMN1; SMN2
SCHEMBL7117023 0.82 SMN1; SMN2 (0.64) TDP1ALDH1A1SMN1; SMN2MAPTKMT2A
SCHEMBL7117313 0.81 ALDH1A1 (0.54) TDP1L3MBTL1ALDH1A1HPGDNPSR1
SCHEMBL2608996 0.81 TDP1 (0.63) TDP1ALDH1A1HPGDNPSR1SMN1; SMN2

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 TDP1 1738/4885L3MBTL1 2231/4885ALDH1A1 901/4885

“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.