SCHEMBL27635124

SCHEMBL27635124

NC(C(=O)O)C(O)CC(=O)OCc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC15A1 P46059 2/20 0.59
SLC1A1 P43005 5/20 0.54
SLC1A3 P43003 4/20 0.54
SLC1A2 P43004 3/20 0.54
KMT2A Q03164 2/20 0.54
MEN1 O00255 1/20 0.54
CYP1A2 P05177 1/20 0.54
CYP2D6 P10635 1/20 0.54
CYP2C9 P11712 1/20 0.54
CYP2C19 P33261 1/20 0.54
ALDH1A1 P00352 4/20 0.53
MAPK1 P28482 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
ABCB1 P08183 1/20 0.49
SLC6A2 P23975 1/20 0.45
SLC6A3 Q01959 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
CDC25B P30305 1/20 0.44
LTA4H P09960 1/20 0.44
LAP3 P28838 1/20 0.44

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
SCHEMBL9781868 1.00 SLC15A1 (0.59) SLC15A1SLC1A1SLC1A3SLC1A2KMT2A
SCHEMBL8447494 1.00 SLC15A1 (0.59) SLC15A1SLC1A1SLC1A3SLC1A2KMT2A
SCHEMBL27713444 0.91 SLC15A1 (0.56) SLC15A1SLC1A1SLC1A3SLC1A2KMT2A
SCHEMBL6546883 0.83 ALDH1A1 (0.59) SLC15A1SLC1A1SLC1A3SLC1A2KMT2A
Hydrochloric Acid SCHEMBL27518479 0.83 ALDH1A1 (0.59) SLC15A1SLC1A1SLC1A3SLC1A2KMT2A
SCHEMBL22804119 0.83 SLC15A1 (0.65) SLC15A1SLC1A1SLC1A3SLC1A2KMT2A
SCHEMBL1241916 0.83 SLC15A1 (0.65) SLC15A1SLC1A1SLC1A3SLC1A2KMT2A
SCHEMBL4523936 0.82 SLC15A1 (0.65) SLC15A1SLC1A1SLC1A3SLC1A2KMT2A
SCHEMBL5898461 0.82 SLC15A1 (0.65) SLC15A1SLC1A1SLC1A3SLC1A2KMT2A
SCHEMBL730848 0.82 SLC15A1 (0.65) SLC15A1SLC1A1SLC1A3SLC1A2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101180296-B Heteroaryl-carboxylic acid (sulfamoyl alkyl) amide - derivatives as factor Xa inhibitors SANOFI AVENTIS 2011-10-19 CN disclosed
CN-101180296-A Heteroaryl-carboxylic acid (sulfamoyl alkyl) amide - derivatives as factor Xa inhibitors SANOFI AVENTIS (FR) 2008-05-14 CN disclosed
CN-1714096-A Mmp inhibitors LEO PHARMA AS (DK) 2005-12-28 CN disclosed