SCHEMBL6203280

SCHEMBL6203280

CCOC[C@H](Cc1ccc(OCc2nc(-c3ccccc3)oc2C)cc1)OC(C)C

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.58
PPARG P37231 17/20 0.58
PPARA Q07869 14/20 0.58
KDR P35968 1/20 0.50
PPARD Q03181 2/20 0.48

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
SCHEMBL6201108 0.91 PPARG (0.60) FFAR1PPARGPPARAKDRPPARD
SCHEMBL6201299 0.89 PPARG (0.59) FFAR1PPARGPPARAKDRPPARD
SCHEMBL4025975 0.86 FFAR1 (0.58) FFAR1PPARGPPARAKDRPPARD
SCHEMBL4028338 0.85 PPARG (0.59) FFAR1PPARGPPARAKDRPPARD
SCHEMBL4028563 0.84 FFAR1 (0.60) FFAR1PPARGPPARAKDRPPARD
SCHEMBL6204434 0.83 FFAR1 (0.59) FFAR1PPARGPPARAPPARD
SCHEMBL4026910 0.82 FFAR1 (0.63) FFAR1PPARGPPARAKDRPPARD
SCHEMBL4027559 0.82 FFAR1 (0.60) FFAR1PPARGPPARAKDRPPARD
SCHEMBL6204574 0.82 PPARG (0.56) FFAR1PPARGPPARAKDRPPARD
SCHEMBL13633933 0.82 PPARG (0.63) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1569916-A1 SUBSTITUTED ARALKYL DERIVATIVES CADILA HEALTHCARE LTD. (IN) 2005-09-07 EP claimed
WO-2004046119-A1 SUBSTITUTED ARALKYL DERIVATIVES CADILA HEALTHCARE LIMITED (IN) 2004-06-03 WO claimed
EP-1569916-A1 SUBSTITUTED ARALKYL DERIVATIVES CADILA HEALTHCARE LTD. (IN) 2005-09-07 EP disclosed
WO-2004046119-A1 SUBSTITUTED ARALKYL DERIVATIVES CADILA HEALTHCARE LIMITED (IN) 2004-06-03 WO disclosed