SCHEMBL7855600

SCHEMBL7855600

O=C(O)C(Cc1ccc(OCCn2c3ccccc3c3cc(Br)ccc32)cc1)OCc1ccccc1

nearest known ligand 0.83

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 17/20 0.83
PPARG P37231 16/20 0.83
PPARD Q03181 5/20 0.68
PTPN1 P18031 1/20 0.44
TSPO P30536 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
SCHEMBL7528924 1.00 PPARA (0.83) PPARAPPARGPPARDPTPN1TSPO
SCHEMBL7536825 0.97 PPARG (0.79) PPARAPPARGPPARD
SCHEMBL7852634 0.91 PPARG (0.80) PPARAPPARGPPARDPTPN1
SCHEMBL7532140 0.91 PPARG (0.80) PPARAPPARGPPARDPTPN1
SCHEMBL7528811 0.91 PPARG (1.00) PPARAPPARGPPARD
SCHEMBL7856304 0.91 PPARG (1.00) PPARAPPARGPPARD
SCHEMBL7526743 0.89 PPARG (0.68) PPARAPPARGPPARDPTPN1
SCHEMBL7590709 0.89 PPARG (0.68) PPARAPPARGPPARDPTPN1
SCHEMBL7535774 0.89 PPARG (0.83) PPARAPPARGPPARDPTPN1TSPO
SCHEMBL7845343 0.89 PPARG (0.83) PPARAPPARGPPARDPTPN1TSPO

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