SCHEMBL5353765

SCHEMBL5353765

CC(Cc1ccc(OC(C)(C)C(=O)O)cc1)Nc1cc(C(F)(F)F)ccc1N1C[C@H](C)C[C@H](C)C1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 13/20 0.44
PPARD Q03181 11/20 0.44
PPARG P37231 7/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
LMNA P02545 1/20 0.40
CNR1 P21554 1/20 0.39
ACACB O00763 1/20 0.37
ALDH1A1 P00352 1/20 0.37
GAA P10253 1/20 0.37
MC4R P32245 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
MAPT P10636 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
HTT P42858 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
DNMT1 P26358 1/20 0.36

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
SCHEMBL5353768 0.87 PPARA (0.43) PPARAPPARDPPARGCNR1ACACB
SCHEMBL5351942 0.81 PPARA (0.47) PPARAPPARDPPARGL3MBTL1CNR1
SCHEMBL14399164 0.78 PPARD (0.43) PPARAPPARDCNR1ACACB
SCHEMBL5329725 0.76 TPH1 (0.40) PPARAPPARDPPARGCNR1ACACB
SCHEMBL5324085 0.74 PPARA (0.48) PPARAPPARDPPARGSMN1; SMN2L3MBTL1
SCHEMBL14399420 0.73 PPARA (0.47) PPARAPPARDPPARGSMN1; SMN2L3MBTL1
SCHEMBL5325989 0.73 PPARA (0.47) PPARAPPARDPPARGSMN1; SMN2L3MBTL1
SCHEMBL5330018 0.72 PPARA (0.47) PPARAPPARDPPARGSMN1; SMN2L3MBTL1
SCHEMBL5325952 0.72 PPARA (0.51) PPARAPPARDPPARGCNR1MC4R
SCHEMBL5326681 0.70 CNR1 (0.48) PPARAPPARDPPARGSMN1; SMN2CNR1

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
WO-2007118963-A2 SUBSTITUTED N-(PHENETHYL)BENZAMIDE DERIVATIVES, PREPARATION AND USES THEREOF GENFIT (FR) 2007-10-25 WO disclosed