SCHEMBL7853471

SCHEMBL7853471

CCOC(Cc1ccc(CCCn2c3ccccc3c3cc(Br)ccc32)cc1)C(=O)O

nearest known ligand 0.77

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PPARG P37231 16/20 0.77
PPARA Q07869 15/20 0.77
PPARD Q03181 6/20 0.62
TSPO P30536 3/20 0.50
CNR2 P34972 1/20 0.42

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
SCHEMBL7527301 1.00 PPARG (0.77) PPARGPPARAPPARDTSPOCNR2
SCHEMBL7527676 0.95 PPARA (0.74) PPARGPPARAPPARDTSPO
SCHEMBL7532542 0.91 PPARA (0.72) PPARGPPARAPPARD
SCHEMBL7852911 0.91 PPARA (0.72) PPARGPPARAPPARD
SCHEMBL7535734 0.89 PPARG (0.62) PPARGPPARAPPARDTSPO
SCHEMBL7856304 0.87 PPARG (1.00) PPARGPPARAPPARD
SCHEMBL7528811 0.87 PPARG (1.00) PPARGPPARAPPARD
SCHEMBL7535616 0.86 PPARA (0.66) PPARGPPARAPPARD
SCHEMBL7855869 0.85 PPARA (0.83) PPARGPPARAPPARD
SCHEMBL7527255 0.85 PPARA (0.83) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1123279-A1 NEW COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 2001-08-16 EP claimed
WO-2000023425-A1 NEW COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 2000-04-27 WO claimed