SCHEMBL14420344

SCHEMBL14420344

CC[C@H](Cc1ccccc1)[C@H](N)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 4/20 0.61
SLC1A2 P43004 4/20 0.61
SLC1A1 P43005 4/20 0.61
ALPI P09923 1/20 0.56
PKM P14618 1/20 0.56
PTGS1 P23219 1/20 0.56
XIAP P98170 1/20 0.56
SLC7A5 Q01650 1/20 0.56
CYP1A2 P05177 2/20 0.50
MEN1 O00255 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
KMT2A Q03164 1/20 0.47
SRR Q9GZT4 2/20 0.47
SLC6A2 P23975 2/20 0.47
TAAR1 Q96RJ0 2/20 0.47
MAOA P21397 1/20 0.47
SLC6A4 P31645 1/20 0.47
SLC6A3 Q01959 1/20 0.47

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
SCHEMBL27644705 1.00 SLC1A3 (0.61) SLC1A3SLC1A2SLC1A1ALPIPKM
SCHEMBL14420246 1.00 SLC1A3 (0.61) SLC1A3SLC1A2SLC1A1ALPIPKM
SCHEMBL27348648 0.89 SLC1A3 (0.69) SLC1A3SLC1A2SLC1A1ALPIPKM
SCHEMBL27665297 0.86 SLC1A3 (0.57) SLC1A3SLC1A2SLC1A1ALPIPKM
SCHEMBL2890750 0.84 SLC1A3 (0.62) SLC1A3SLC1A2SLC1A1ALPIPKM
SCHEMBL2890748 0.84 SLC1A3 (0.62) SLC1A3SLC1A2SLC1A1ALPIPKM
SCHEMBL1101111 0.82 SLC1A3 (0.61) SLC1A3SLC1A2SLC1A1ALPIPKM
SCHEMBL4367490 0.82 SLC1A3 (0.61) SLC1A3SLC1A2SLC1A1ALPIPKM
SCHEMBL28912223 0.81 CYP1A2 (0.53) SLC1A3SLC1A2SLC1A1ALPIPKM
Diethylamine SCHEMBL29024453 0.81 SLC1A3 (0.51) SLC1A3SLC1A2SLC1A1ALPIPKM

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-2007107008-A1 COMPOUNDS AND COMPOSITIONS FOR USE IN THE PREVENTION AND TREATMENT OF DISORDERS OF FAT METABOLISM AND OBESITY INNODIA INC. (CA) 2007-09-27 WO disclosed