SCHEMBL6421706

SCHEMBL6421706

CCOC(=O)C(Cc1ccc(OCCC(c2ccccc2)c2ccccc2)cc1)OCC

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 17/20 0.59
PPARG P37231 15/20 0.59
PPARD Q03181 7/20 0.59
TDP1 Q9NUW8 1/20 0.49

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
SCHEMBL6421676 0.96 PPARA (0.55) PPARAPPARGPPARD
SCHEMBL6418466 0.94 PPARA (0.54) PPARAPPARGPPARD
SCHEMBL6420459 0.90 PPARA (0.72) PPARAPPARGPPARD
SCHEMBL6420564 0.87 PPARA (0.65) PPARAPPARGPPARD
SCHEMBL6422692 0.85 PPARA (0.65) PPARAPPARGPPARD
SCHEMBL5380615 0.84 PPARA (0.82) PPARAPPARGPPARDTDP1
SCHEMBL5386183 0.84 PPARA (0.67) PPARAPPARGPPARD
SCHEMBL5386198 0.84 PPARA (0.67) PPARAPPARGPPARD
SCHEMBL4758109 0.83 PPARA (0.75) PPARAPPARGPPARD
SCHEMBL15811673 0.83 PPARA (0.75) PPARAPPARGPPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6972294-B1 Compounds, their preparation and use NOVO NORDISK, A/S (DK) 2005-12-06 US claimed
JP-2002542218-A 2002-12-10 JP claimed
EP-1171414-A1 COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 2002-01-16 EP claimed
WO-2000063153-A1 NEW COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 2000-10-26 WO claimed
US-6972294-B1 Compounds, their preparation and use NOVO NORDISK, A/S (DK) 2005-12-06 US disclosed
EP-1171414-A1 COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 2002-01-16 EP disclosed
WO-2000063153-A1 NEW COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 2000-10-26 WO disclosed