SCHEMBL6356875

SCHEMBL6356875

N[C@@H](Cc1ccccc1)C(O)C1=NCCO1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC15A1 P46059 1/20 0.39
CSNK1E P49674 1/20 0.38
LAP3 P28838 7/20 0.38
ANPEP P15144 4/20 0.38
EPHX1 P07099 1/20 0.38
ADRA2A P08913 1/20 0.37
ADRA2B P18089 1/20 0.37
ADRA2C P18825 1/20 0.37
ALPI P09923 1/20 0.37
PKM P14618 1/20 0.37
PTGS1 P23219 1/20 0.37
XIAP P98170 1/20 0.37
SLC7A5 Q01650 1/20 0.37
SLC6A2 P23975 2/20 0.36
TAAR1 Q96RJ0 2/20 0.36
MAOA P21397 1/20 0.36
SLC6A4 P31645 1/20 0.36
SLC6A3 Q01959 1/20 0.36
SIGMAR1 Q99720 1/20 0.36
CYP2A6 P11509 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
SCHEMBL8059667 1.00 SLC15A1 (0.39) SLC15A1CSNK1ELAP3ANPEPEPHX1
SCHEMBL6356872 0.73 LAP3 (0.41) SLC15A1CSNK1ELAP3ANPEPEPHX1
SCHEMBL7360089 0.73 LAP3 (0.41) SLC15A1CSNK1ELAP3ANPEPEPHX1
SCHEMBL7361004 0.72 CYP2C19 (0.43) SLC15A1CSNK1ELAP3ANPEPEPHX1
SCHEMBL6349525 0.72 TRPM8 (0.49)
SCHEMBL6347819 0.71 CSNK1E (0.41) SLC15A1CSNK1ELAP3ANPEPEPHX1
SCHEMBL27502071 0.70 EPHX1 (0.52) SLC15A1CSNK1ELAP3ANPEPEPHX1
SCHEMBL10591601 0.70 CSNK1E (0.40) SLC15A1CSNK1ELAP3ANPEPEPHX1
SCHEMBL6356479 0.67 EPHX1 (0.58) SLC15A1CSNK1ELAP3ANPEPEPHX1
SCHEMBL6929688 0.67 EPHX1 (0.58) SLC15A1CSNK1ELAP3ANPEPEPHX1

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
US-6960575-B2 For use as inhibitors of chymase SANTEN PHARMACEUTICAL CO., LTD. (JP) 2005-11-01 US disclosed
US-6713472-B1 2-OXO-1,2,3,4-TETRAHYDROPYRAZINE DERIVATIVES; CHYMASE INHIBITORS SANTEN PHARMACEUTICAL CO., LTD. (JP) 2004-03-30 US disclosed