SCHEMBL6956263

SCHEMBL6956263

CC(C)OC(Cc1ccc(OCCn2ccc3ccccc3c2=O)cc1)C(N)=O

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARG P37231 16/20 0.45
PPARA Q07869 13/20 0.45
PPARD Q03181 7/20 0.45
TNF P01375 1/20 0.42
PSMB1 P20618 1/20 0.42
PSMB5 P28074 1/20 0.42
FFAR1 O14842 1/20 0.39
RAB9A P51151 1/20 0.39
MAPK1 P28482 1/20 0.39

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
SCHEMBL6949013 0.88 PPARG (0.47) PPARGPPARAPPARD
SCHEMBL6954580 0.84 TNF (0.41) PPARGPPARAPPARDTNFPSMB1
SCHEMBL6955465 0.84 MAPK1 (0.59) RAB9AMAPK1
SCHEMBL6952445 0.83 NPC1 (0.59) PPARGPPARAPPARDRAB9A
SCHEMBL6952622 0.82 TNF (0.44) PPARGPPARAPPARDTNFPSMB1
SCHEMBL6954585 0.82 TNF (0.41) PPARGPPARAPPARDTNFPSMB1
SCHEMBL6948727 0.80 PPARG (0.56) PPARGPPARAPPARDTNFRAB9A
SCHEMBL6952202 0.79 PPARG (0.45) PPARGPPARAPPARDTNFPSMB1
SCHEMBL6949766 0.77 PPARG (0.46) PPARGPPARAPPARDRAB9A
SCHEMBL6957273 0.77 PPARG (0.47) PPARGPPARAPPARDTNFRAB9A

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-0903343-B1 Alpha-Substituted phenylpropionic acid derivative and medicine containing the same SSP CO LTD (JP) 2003-05-28 EP disclosed
EP-0903343-A1 Alpha-Substituted phenylpropionic acid derivative and medicine containing the same SSP Co., Ltd. (JP) 1999-03-24 EP disclosed