SCHEMBL11449999

SCHEMBL11449999

CC(Oc1ccc(Oc2ccc(Cl)cc2)cc1)C(=O)OCC(=O)c1ccccc1Cl

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARG P37231 5/20 0.43
PPARA Q07869 5/20 0.43
L3MBTL1 Q9Y468 4/20 0.42
EPHX2 P34913 1/20 0.42
MAPT P10636 3/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
GAA P10253 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
LMNA P02545 1/20 0.41
PNLIP P16233 1/20 0.40
AGTR1 P30556 1/20 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
SCHEMBL11452400 0.89 FFAR1 (0.49) L3MBTL1MAPTMEN1KMT2ATDP1
SCHEMBL11451494 0.88 CYP11B1 (0.45) PPARGPPARAL3MBTL1MAPTMEN1
SCHEMBL11450230 0.85 MAPT (0.51) PPARGPPARAL3MBTL1MAPTMEN1
SCHEMBL11451159 0.79 MEN1 (0.48) PPARGPPARAL3MBTL1MEN1KMT2A
SCHEMBL10964710 0.77 EPHX2 (0.62) PPARGPPARAL3MBTL1EPHX2MAPT
SCHEMBL4637996 0.77 NPC1 (0.56) MAPTMEN1KMT2ALMNA
SCHEMBL163796 0.76 CYP1A2 (0.50) PPARGPPARAL3MBTL1EPHX2MAPT
SCHEMBL11450033 0.75 PPARG (0.47) PPARGPPARAL3MBTL1MAPTKMT2A
SCHEMBL10968135 0.75 L3MBTL1 (0.50) PPARGPPARAL3MBTL1EPHX2MAPT
SCHEMBL11646451 0.75 PPARA (0.53) PPARGPPARAMAPTGAATDP1

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-0019796-A1 Propionic acid esters, preparation of these compounds, herbicides containing these compounds as active substances, and the use of such compounds and agents for combating weeds F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1980-12-10 EP claimed
EP-0019796-A1 Propionic acid esters, preparation of these compounds, herbicides containing these compounds as active substances, and the use of such compounds and agents for combating weeds F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1980-12-10 EP disclosed