SCHEMBL7702965

SCHEMBL7702965

C1CCC(NC2CCCCC2)CC1.CC(=CC(=O)c1ccccc1)N[C@@H](Cc1ccc(OCCN(C)c2nc3ccccc3o2)cc1)C(=O)O.CN(CCOc1ccc(CC(Nc2ccccc2C(=O)c2ccccc2)C(=O)O)cc1)c1nc2ccccc2o1

nearest known ligand 0.73

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 20/20 0.73
▸ PPARA Q07869 1/20 0.73

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
SCHEMBL7920800 0.93 PPARG (0.63) PPARGPPARA
SCHEMBL7705750 0.88 PPARG (0.58) PPARGPPARA
SCHEMBL7914542 0.86 PPARG (1.00) PPARGPPARA
SCHEMBL2808629 0.86 PPARG (0.68) PPARGPPARA
SCHEMBL2786618 0.86 PPARG (1.00) PPARGPPARA
SCHEMBL7708833 0.82 PPARG (1.00) PPARGPPARA
SCHEMBL2785697 0.82 PPARG (1.00) PPARGPPARA
SCHEMBL2786747 0.82 PPARG (1.00) PPARGPPARA
SCHEMBL2787384 0.82 PPARG (1.00) PPARGPPARA
SCHEMBL2785124 0.82 PPARG (1.00) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-3255930-B2 — — 2002-02-12 — — JP claimed
JP-2000507216-A — — 2000-06-13 — — JP claimed
EP-0888317-A1 SUBSTITUTED 4-HYDROXY-PHENYLALCANOIC ACID DERIVATIVES WITH AGONIST ACTIVITY TO PPAR-GAMMA GLAXO GROUP LIMITED (GB) 1999-01-07 — — EP claimed
WO-1997031907-A1 SUBSTITUTED 4-HYDROXY-PHENYLALCANOIC ACID DERIVATIVES WITH AGONIST ACTIVITY TO PPAR-GAMMA GLAXO GROUP LIMITED (GB) 1997-09-04 — — WO claimed
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