SCHEMBL7514537

SCHEMBL7514537

O=C(O)C(Cc1ccc(OCCN2c3ccccc3Oc3ccccc32)cc1)C(=O)O

nearest known ligand 0.74

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARG P37231 11/20 0.74
PPARA Q07869 8/20 0.74
PPARD Q03181 5/20 0.49
CACNA1B Q00975 5/20 0.44
CACNA1H O95180 2/20 0.44
LDHA P00338 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
SCHEMBL6004633 0.91 PPARG (0.72) PPARGPPARAPPARDCACNA1BCACNA1H
SCHEMBL5345508 0.91 PPARG (0.72) PPARGPPARAPPARDCACNA1BCACNA1H
SCHEMBL7517998 0.89 PPARG (0.66) PPARGPPARAPPARDCACNA1BCACNA1H
SCHEMBL7928584 0.88 PPARG (0.81) PPARGPPARAPPARD
SCHEMBL6002510 0.88 PPARG (0.77) PPARGPPARA
Ragaglitazar SCHEMBL682732 0.86 PPARA (1.00) PPARGPPARAPPARD
Ragaglitazar SCHEMBL29369224 0.86 PPARA (1.00) PPARGPPARAPPARD
Ragaglitazar SCHEMBL676872 0.86 PPARA (1.00) PPARGPPARAPPARD
Ragaglitazar SCHEMBL4822459 0.86 PPARA (1.00) PPARGPPARAPPARD
SCHEMBL6002537 0.84 PPARG (0.85) PPARGPPARAPPARD

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
JP-2002542237-A 2002-12-10 JP claimed
US-20020128260-A1 Useful in the treatment and/or prevention of conditions mediated by nuclear receptors, in particular the Peroxisome Proliferator-Activated Receptors (PPAR); fused ring derivatives of malonic acid, ester or amides JEPPESEN LONE (DK) 2002-09-12 US claimed
US-6369055-B1 TREATMENT OF CONDITIONS MEDIATED BY NUCLEAR RECEPTORS, IN PARTICULAR THE PEROXISOME PROLIFERATOR-ACTIVATED RECEPTORS (PPAR); LOWERING BOTH HYPERTRIGLYCERIDEMIA AND HYPERGLYCEMIA, 2-(4-(2-PHENOXAZINE-10-YL-ETHOXY)-BENZYL)-MALONIC ACID NOVO NORDISK A/S (DK) 2002-04-09 US claimed
EP-1171431-A1 COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 2002-01-16 EP claimed
WO-2000063190-A1 NEW COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 2000-10-26 WO claimed
US-20020128260-A1 Useful in the treatment and/or prevention of conditions mediated by nuclear receptors, in particular the Peroxisome Proliferator-Activated Receptors (PPAR); fused ring derivatives of malonic acid, ester or amides JEPPESEN LONE (DK) 2002-09-12 US disclosed
US-6369055-B1 TREATMENT OF CONDITIONS MEDIATED BY NUCLEAR RECEPTORS, IN PARTICULAR THE PEROXISOME PROLIFERATOR-ACTIVATED RECEPTORS (PPAR); LOWERING BOTH HYPERTRIGLYCERIDEMIA AND HYPERGLYCEMIA, 2-(4-(2-PHENOXAZINE-10-YL-ETHOXY)-BENZYL)-MALONIC ACID NOVO NORDISK A/S (DK) 2002-04-09 US disclosed
EP-1171431-A1 COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 2002-01-16 EP disclosed
WO-2000063190-A1 NEW COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 2000-10-26 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-20020128260-A1 Useful in the treatment and/or prevention of conditions mediated by nuclear receptors, in particular the Peroxisome Proliferator-Activated Receptors (PPAR); fused ring derivatives of malonic acid, ester or amides PPARG, PPARA, PPARD PPARG 1/4885PPARA 2/4885PPARD 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.