SCHEMBL4059860

SCHEMBL4059860

CCCc1c(OCCCOc2ccc3[nH]cc(CC(=O)O)c3c2)ccc2c(-c3ccccc3)noc12

nearest known ligand 0.71

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 19/20 0.71
PPARG P37231 19/20 0.71
PPARD Q03181 19/20 0.71

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
SCHEMBL4063144 0.88 PPARD (0.71) PPARAPPARGPPARD
SCHEMBL4063560 0.86 PPARD (0.69) PPARAPPARGPPARD
SCHEMBL4063178 0.86 PPARG (0.75) PPARAPPARGPPARD
SCHEMBL7042295 0.83 PPARA (1.00) PPARAPPARGPPARD
SCHEMBL2001665 0.82 PPARD (0.72) PPARAPPARGPPARD
SCHEMBL7038856 0.81 PPARA (1.00) PPARAPPARGPPARD
SCHEMBL4060698 0.81 PPARG (0.64) PPARAPPARGPPARD
SCHEMBL2896562 0.81 PPARA (1.00) PPARAPPARGPPARD
SCHEMBL4054594 0.81 PPARG (0.65) PPARAPPARGPPARD
SCHEMBL7038946 0.79 PPARG (1.00) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1689389-A4 INDOLE COMPOUNDS NAT HEALTH RESEARCH INSTITUTES (TW) 2009-06-17 EP disclosed
EP-1689389-A2 INDOLE COMPOUNDS National Health Research Institutes (TW) 2006-08-16 EP disclosed
WO-2005056522-A2 INDOLE COMPOUNDS NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2005-06-23 WO disclosed