SCHEMBL15327593

SCHEMBL15327593

CC(C)(C)OC(NC=O)C(N)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 1/20 0.38
SLC1A2 P43004 1/20 0.38
SLC1A1 P43005 1/20 0.38
SLC7A5 Q01650 1/20 0.34
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
PTGS1 P23219 1/20 0.31

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
Hydrochloric Acid SCHEMBL7210373 0.98 SLC1A3 (0.37) SLC1A3SLC1A2SLC1A1SLC7A5ALDH1A1
SCHEMBL4272520 0.81 ADH1B (0.34)
SCHEMBL17416331 0.81 ADH1B (0.30)
SCHEMBL7659266 0.76 SLC1A3 (0.35) SLC1A3SLC1A2SLC1A1ALDH1A1MAPT
SCHEMBL28097907 0.72 PGD (0.36)
SCHEMBL28858703 0.70 ADH1B (0.30)
SCHEMBL6289098 0.70 TSHR (0.31)
SCHEMBL1693985 0.69 SLC7A5 (0.48) SLC1A3SLC1A2SLC1A1SLC7A5ALDH1A1
SCHEMBL8352984 0.69 SLC7A5 (0.48) SLC1A3SLC1A2SLC1A1SLC7A5ALDH1A1
SCHEMBL1770797 0.69 SLC7A5 (0.48) SLC1A3SLC1A2SLC1A1SLC7A5ALDH1A1

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
EP-2477968-B1 N-[2-HYDROXYCARBAMOYL-2-(PIPERAZINYL)ETHYL]BENZAMIDE COMPOUNDS, THEIR PREPARATION AND THEIR USE AS TACE INHIBITORS GALDERMA RES & DEV (FR) 2013-10-23 EP disclosed