SCHEMBL29995490

SCHEMBL29995490

N[C@H](COc1cccc(F)c1)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.51
PPARA Q07869 1/20 0.51
SLC1A5 Q15758 1/20 0.50
SLC6A9 P48067 1/20 0.48
SLC6A5 Q9Y345 1/20 0.48
NR4A2 P43354 1/20 0.47
MEN1 O00255 1/20 0.46
ALDH1A1 P00352 1/20 0.46
HPGD P15428 1/20 0.46
KMT2A Q03164 1/20 0.46
SLC1A1 P43005 2/20 0.46
MRGPRX4 Q96LA9 1/20 0.44
GPR34 Q9UPC5 1/20 0.44
USP2 O75604 1/20 0.43
MAOB P27338 1/20 0.43
TRPV4 Q9HBA0 1/20 0.42
LMNA P02545 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
PTPN1 P18031 1/20 0.41

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
SCHEMBL29994776 1.00 PPARG (0.51) PPARGPPARASLC1A5SLC6A9SLC6A5
SCHEMBL28432474 1.00 PPARG (0.51) PPARGPPARASLC1A5SLC6A9SLC6A5
SCHEMBL28437354 1.00 PPARG (0.51) PPARGPPARASLC1A5SLC6A9SLC6A5
SCHEMBL28429123 1.00 PPARG (0.51) PPARGPPARASLC1A5SLC6A9SLC6A5
SCHEMBL3449821 0.81 SCN4A (0.55) PPARGPPARASLC1A5SLC1A1LMNA
SCHEMBL3449820 0.81 SCN4A (0.55) PPARGPPARASLC1A5SLC1A1LMNA
SCHEMBL30963049 0.81 SCN4A (0.55) PPARGPPARASLC1A5SLC1A1LMNA
SCHEMBL16095798 0.81 ADRB2 (0.50) KMT2ALMNASMN1; SMN2
SCHEMBL21838061 0.81 RXRA (0.51) PPARGPPARANR4A2
SCHEMBL21671284 0.81 RXRA (0.51) PPARGPPARANR4A2

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
CN-111333528-B Synthesis method of multi-configuration O-phenyl-serine compound 苏州爱玛特生物科技有限公司 2022-10-21 CN disclosed