SCHEMBL6149805

SCHEMBL6149805

CO[C@@H](Cc1cccc(OC(C)CC(=O)NCCc2ccc(Cl)cc2Cl)c1)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.51
PPARA Q07869 4/20 0.44
PPARG P37231 3/20 0.44
PLAAT3 P53816 1/20 0.43
PLAAT5 Q96KN8 1/20 0.43
PLAAT2 Q9NWW9 1/20 0.43
PLAAT4 Q9UL19 1/20 0.43
METAP2 P50579 1/20 0.42
CTSD P07339 1/20 0.42
LMNA P02545 2/20 0.41
TP53 P04637 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
CNR1 P21554 2/20 0.41
MAPK1 P28482 1/20 0.41
ATM Q13315 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
HTT P42858 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
SCHEMBL6150597 0.91 PPARA (0.47) HPGDPPARAPPARGCTSDMAPK1
SCHEMBL6150725 0.89 ALDH1A1 (0.49) HPGDPPARAPPARGPLAAT3PLAAT5
SCHEMBL6149147 0.87 PPARG (0.42) PPARAPPARGCNR1HTT
SCHEMBL5364836 0.82 HPGD (0.46) HPGDPPARAPPARGPLAAT3PLAAT5
SCHEMBL6150329 0.82 PPARA (0.48) HPGDPPARAPPARG
SCHEMBL6150826 0.79 EPHX2 (0.44) HPGD
SCHEMBL6148908 0.78 AOC3 (0.49) HPGDPPARAPPARGL3MBTL1HTT
SCHEMBL6150313 0.75 KMT2A (0.49) PPARAPPARG
SCHEMBL6150631 0.74 PPARA (0.47) HPGDPPARAPPARG
SCHEMBL6150164 0.73 MTNR1A (0.44) PPARAPPARGLMNARAB9A

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-1517882-A1 AMIDE LINKER PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2005-03-30 EP disclosed
WO-2004000789-A1 AMIDE LINKER PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2003-12-31 WO disclosed