SCHEMBL11025286

SCHEMBL11025286

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

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC15A1 P46059 2/20 0.51
ALPI P09923 1/20 0.50
PKM P14618 1/20 0.50
PTGS1 P23219 1/20 0.50
XIAP P98170 1/20 0.50
SLC7A5 Q01650 1/20 0.50
EPHX1 P07099 1/20 0.48
LAP3 P28838 5/20 0.47
ANPEP P15144 2/20 0.47
CSNK1E P49674 1/20 0.46
SLC1A3 P43003 2/20 0.46
SLC1A2 P43004 2/20 0.46
SLC1A1 P43005 2/20 0.46
SLC6A2 P23975 2/20 0.45
TAAR1 Q96RJ0 2/20 0.45
MAOA P21397 1/20 0.45
SLC6A4 P31645 1/20 0.45
SLC6A3 Q01959 1/20 0.45
SIGMAR1 Q99720 1/20 0.45
CYP2A6 P11509 1/20 0.45

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
SCHEMBL6580781 1.00 SLC15A1 (0.51) SLC15A1ALPIPKMPTGS1XIAP
SCHEMBL6243841 1.00 SLC15A1 (0.51) SLC15A1ALPIPKMPTGS1XIAP
SCHEMBL8690443 0.81 EPHX1 (0.48) SLC15A1ALPIPKMPTGS1XIAP
SCHEMBL11412673 0.81 EPHX1 (0.48) SLC15A1ALPIPKMPTGS1XIAP
SCHEMBL9675556 0.79 CSNK1E (0.53) SLC15A1ALPIPKMPTGS1XIAP
SCHEMBL6730587 0.78 SLC6A4 (0.54) ANPEPTAAR1SLC6A4CYP1A2
SCHEMBL9740410 0.77 EPHX1 (0.58) SLC15A1ALPIPKMPTGS1XIAP
SCHEMBL7190709 0.77 EPHX1 (0.58) SLC15A1ALPIPKMPTGS1XIAP
SCHEMBL6446370 0.77 EPHX1 (0.58) SLC15A1ALPIPKMPTGS1XIAP
SCHEMBL22431194 0.77 EPHX1 (0.58) SLC15A1ALPIPKMPTGS1XIAP

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0077274-B1 3-AMINO-2-HYDROXY-4-PHENYLBUTANOIC ACID DERIVATIVES AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1985-08-28 EP claimed
US-4474764-A ANALGESICS ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1984-10-02 US claimed
EP-0077274-A1 3-Amino-2-hydroxy-4-phenylbutanoic acid derivatives and pharmaceutical composition containing the same ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1983-04-20 EP claimed
EP-0077274-B1 3-AMINO-2-HYDROXY-4-PHENYLBUTANOIC ACID DERIVATIVES AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1985-08-28 EP disclosed
US-4474764-A ANALGESICS ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1984-10-02 US disclosed
EP-0077274-A1 3-Amino-2-hydroxy-4-phenylbutanoic acid derivatives and pharmaceutical composition containing the same ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1983-04-20 EP disclosed