SCHEMBL6933335

SCHEMBL6933335

COC(=O)c1ccc(N(Cc2ccccc2)c2ccccc2NC(=O)c2cccc([N+](=O)[O-])c2)cc1C(=O)OC

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.50
KMT2A Q03164 6/20 0.50
ALDH1A1 P00352 4/20 0.50
MAPT P10636 6/20 0.48
PYGL P06737 3/20 0.47
PYGM P11217 2/20 0.47
ABCG2 Q9UNQ0 1/20 0.47
LMNA P02545 1/20 0.46
HTT P42858 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2C19 P33261 1/20 0.45
GAA P10253 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
HPGD P15428 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
GPR35 Q9HC97 1/20 0.44

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
SCHEMBL6933328 0.89 PYGL (0.57) MEN1KMT2AALDH1A1MAPTPYGL
SCHEMBL6933340 0.89 PYGL (0.50) MEN1KMT2AALDH1A1MAPTPYGL
SCHEMBL7198575 0.87 MEN1 (0.46) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL7119414 0.81 AR (0.51) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL7198582 0.77 AR (0.46) MEN1KMT2AALDH1A1MAPTHTT
SCHEMBL7118343 0.77 ABCG2 (0.54) MEN1KMT2AALDH1A1MAPTPYGL
SCHEMBL4094329 0.77 KMT2A (0.66) MEN1KMT2AALDH1A1MAPTABCG2
SCHEMBL7122268 0.76 KMT2A (0.56) MEN1KMT2AALDH1A1MAPTPYGL
SCHEMBL6431792 0.74 PYGL (0.78) MEN1KMT2AMAPTPYGLPYGM
SCHEMBL7126620 0.74 THRA (0.57) MEN1KMT2AALDH1A1MAPTPYGL

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 9 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 claimed
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 claimed
JP-2003510304-A 2003-03-18 JP claimed
EP-1220832-A1 NOVEL AROMATIC COMPOUNDS NOVO NORDISK A/S (DK) 2002-07-10 EP claimed
WO-2001023347-A1 NOVEL AROMATIC COMPOUNDS NOVO NORDISK A/S (DK) 2001-04-05 WO claimed
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 MEN1 2301/4885KMT2A 971/4885ALDH1A1 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.