SCHEMBL7921358

SCHEMBL7921358

COC(=O)C(Cc1ccc(OCCN(C)c2nc3ccccc3o2)cc1)Cc1ccccc1Br

nearest known ligand 0.69

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 20/20 0.69
▸ PPARA Q07869 2/20 0.61

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
SCHEMBL2785850 0.92 PPARG (0.72) PPARGPPARA
SCHEMBL7920689 0.90 PPARG (0.77) PPARGPPARA
SCHEMBL7705744 0.89 PPARG (0.59) PPARGPPARA
SCHEMBL9288468 0.88 PPARG (0.76) PPARGPPARA
SCHEMBL9220466 0.88 PPARG (0.76) PPARGPPARA
Trifluoroacetic Acid SCHEMBL7705747 0.88 PPARG (0.67) PPARGPPARA
SCHEMBL9285969 0.86 PPARG (0.77) PPARGPPARA
SCHEMBL9222257 0.86 PPARG (0.73) PPARGPPARA
SCHEMBL9215366 0.86 PPARG (0.73) PPARGPPARA
SCHEMBL9276908 0.85 PPARG (0.72) PPARGPPARA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0888317-B1 SUBSTITUTED 4-HYDROXY-PHENYLALCANOIC ACID DERIVATIVES WITH AGONIST ACTIVITY TO PPAR-GAMMA GLAXO GROUP LTD (GB) 2001-09-12 — — EP disclosed
EP-0888317-A1 SUBSTITUTED 4-HYDROXY-PHENYLALCANOIC ACID DERIVATIVES WITH AGONIST ACTIVITY TO PPAR-GAMMA GLAXO GROUP LIMITED (GB) 1999-01-07 — — EP disclosed
WO-1997031907-A1 SUBSTITUTED 4-HYDROXY-PHENYLALCANOIC ACID DERIVATIVES WITH AGONIST ACTIVITY TO PPAR-GAMMA GLAXO GROUP LIMITED (GB) 1997-09-04 — — WO disclosed
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