SCHEMBL3884528

SCHEMBL3884528

CCC(Cc1ccc(OCC2CCCCC2)c(-c2ccc3ccccc3c2)c1)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PPARG P37231 10/20 0.46
PPARA Q07869 11/20 0.42
C5AR1 P21730 1/20 0.42
PPARD Q03181 5/20 0.42
PLA2G10 O15496 1/20 0.41
PLA2G2A P14555 1/20 0.41
KEAP1 Q14145 2/20 0.40
NFE2L2 Q16236 2/20 0.40

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
SCHEMBL3883672 0.91 PPARG (0.44) PPARGPPARAPPARD
SCHEMBL3882409 0.88 PTGER1 (0.42) PPARGPPARAC5AR1PPARDPLA2G10
SCHEMBL3882927 0.86 PPARG (0.44) PPARGPPARAC5AR1PPARDPLA2G10
SCHEMBL3889302 0.85 PPARG (0.46) PPARGPPARAPPARDPLA2G10PLA2G2A
SCHEMBL3682912 0.83 THRA (0.46) PPARAC5AR1PPARD
SCHEMBL3883278 0.82 C5AR1 (0.41) PPARGPPARAC5AR1PPARDKEAP1
SCHEMBL3888439 0.82 FFAR4 (0.54) PPARAC5AR1PPARD
SCHEMBL3888367 0.81 PDE4B (0.44) PPARGPPARAPPARDKEAP1NFE2L2
SCHEMBL3883274 0.81 FFAR4 (0.55) PPARAC5AR1PPARD
SCHEMBL3882136 0.80 PPARG (0.41) PPARGPPARAC5AR1PPARDPLA2G10

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1477472-B1 SUBSTITUTED PHENYLALKANOIC ACID DERIVATIVE AND USE THEREOF ASAHI KASEI PHARMA CORP (JP) 2009-01-14 EP claimed