SCHEMBL6265774

SCHEMBL6265774

CCC(=NOCCN(C)c1cccc(CC(=O)O)c1)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 5/20 0.41
PPARA Q07869 5/20 0.41
PPARD Q03181 2/20 0.40
NR1H2 P55055 1/20 0.40
NR1H3 Q13133 1/20 0.40
NR1H4 Q96RI1 2/20 0.37
PTPN11 Q06124 1/20 0.37
LMNA P02545 2/20 0.36
ABCC4 O15439 1/20 0.36
GAA P10253 1/20 0.36
TSHR P16473 1/20 0.36
PTGS1 P23219 1/20 0.36
HTT P42858 1/20 0.36
BCL2 P10415 1/20 0.36
MTNR1A P48039 2/20 0.36
MTNR1B P49286 2/20 0.36
PTGIR P43119 1/20 0.35
MAPT P10636 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL6265768 1.00 PPARG (0.41) PPARGPPARAPPARDNR1H2NR1H3
SCHEMBL5429179 0.92 PPARG (0.40) PPARGPPARALMNABCL2MTNR1A
SCHEMBL5429174 0.92 PPARG (0.40) PPARGPPARALMNABCL2MTNR1A
SCHEMBL5432570 0.84 S1PR1 (0.45) PPARGPPARALMNAMAPTSMN1; SMN2
SCHEMBL5432566 0.84 S1PR1 (0.45) PPARGPPARALMNAMAPTSMN1; SMN2
SCHEMBL5427399 0.83 PPARA (0.46) PPARGPPARAPPARDNR1H4PTPN11
SCHEMBL5427391 0.83 PPARA (0.46) PPARGPPARAPPARDNR1H4PTPN11
SCHEMBL5414627 0.81 PPARG (0.51) PPARGPPARAPPARDNR1H3PTPN11
SCHEMBL5427796 0.81 PPARG (0.51) PPARGPPARAPPARDNR1H3PTPN11
SCHEMBL5414621 0.81 PPARG (0.51) PPARGPPARAPPARDNR1H3PTPN11

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-1602642-A1 IMINO ETHER DERIVATIVE COMPOUNDS AND DRUGS CONTAINING THE COMPOUNDS AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2005-12-07 EP disclosed