SCHEMBL5205259

SCHEMBL5205259

CCOC(=O)CCC(=O)N(Cc1ccc(O[Si](C)(C)C(C)(C)C)cc1)c1ccc(Cl)cc1Oc1cccc(CNC(=O)OC(C)(C)C)c1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPARG P37231 6/20 0.38
PPARD Q03181 6/20 0.38
PPARA Q07869 6/20 0.38
DRD2 P14416 1/20 0.35
MDM2 Q00987 1/20 0.33
KDM4E B2RXH2 1/20 0.33
TSPO P30536 1/20 0.33
ANO1 Q5XXA6 1/20 0.33
P2RX3 P56373 1/20 0.32
FAAH O00519 1/20 0.32
ALOX15 P16050 1/20 0.32
FDFT1 P37268 1/20 0.32
GLS O94925 1/20 0.32

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
SCHEMBL5203510 0.90 PPARG (0.39) PPARGPPARDPPARAMDM2TSPO
SCHEMBL5201664 0.88 TSHR (0.43) PPARGPPARDPPARAMDM2TSPO
SCHEMBL5206426 0.85 PPARG (0.38) PPARGPPARDPPARAMDM2TSPO
SCHEMBL5205377 0.82 PPARG (0.40) PPARGPPARDPPARATSPOANO1
SCHEMBL5205381 0.81 HDAC1 (0.41) PPARGPPARDPPARATSPOFDFT1
SCHEMBL5208124 0.80 PPARG (0.40) PPARGPPARDPPARATSPOFDFT1
SCHEMBL5208608 0.80 PPARG (0.38) PPARGPPARDPPARAKDM4EANO1
SCHEMBL5201675 0.77 PPARG (0.40) PPARGPPARDPPARAMDM2TSPO
SCHEMBL5204994 0.77 ALDH1A1 (0.40) PPARGPPARDPPARAKDM4ETSPO
SCHEMBL5203418 0.76 ALDH1A1 (0.40) PPARGPPARDPPARAKDM4ETSPO

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
US-7160887-B1 Aromatic amine derivatives, their production and use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-01-09 US disclosed
EP-1123918-B1 AROMATIC AMINE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF AND AGENTS CONTAINING THE SAME TAKEDA PHARMACEUTICAL (JP) 2005-03-09 EP disclosed
EP-1123918-A1 AROMATIC AMINE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF AND AGENTS CONTAINING THE SAME Takeda Chemical Industries, Ltd. (JP) 2001-08-16 EP disclosed