SCHEMBL4063178

SCHEMBL4063178

CCCc1c(OCCCOc2cccc3[nH]cc(CC(=O)O)c23)ccc2c(-c3ccccc3)noc12

nearest known ligand 0.75

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARG P37231 19/20 0.75
PPARD Q03181 19/20 0.75
PPARA Q07869 19/20 0.75

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
SCHEMBL4055211 0.88 NR1H3 (0.65) PPARGPPARDPPARA
SCHEMBL4065858 0.86 NR1H3 (0.66) PPARGPPARDPPARA
SCHEMBL4059860 0.86 PPARA (0.71) PPARGPPARDPPARA
SCHEMBL4063594 0.86 NR1H3 (0.65) PPARGPPARDPPARA
SCHEMBL4064059 0.85 NR1H3 (0.62) PPARGPPARDPPARA
SCHEMBL4063625 0.82 PPARG (0.63) PPARGPPARDPPARA
SCHEMBL4064129 0.82 PPARG (0.64) PPARGPPARDPPARA
SCHEMBL4054417 0.81 PPARG (0.59) PPARGPPARDPPARA
SCHEMBL4052861 0.80 NR1H2 (0.57) PPARGPPARDPPARA
SCHEMBL4059815 0.80 PPARG (0.62) PPARGPPARDPPARA

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