SCHEMBL7659266

SCHEMBL7659266

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

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 4/20 0.35
SLC1A2 P43004 4/20 0.35
SLC1A1 P43005 4/20 0.35
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
PTGS1 P23219 1/20 0.32

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
SCHEMBL28858703 0.83 ADH1B (0.30)
SCHEMBL17416331 0.79 ADH1B (0.30)
SCHEMBL15327593 0.76 SLC1A3 (0.38) SLC1A3SLC1A2SLC1A1ALDH1A1MAPT
Hydrochloric Acid SCHEMBL7210373 0.75 SLC1A3 (0.37) SLC1A3SLC1A2SLC1A1ALDH1A1MAPT
SCHEMBL1196065 0.75 SLC1A3 (0.39) SLC1A3SLC1A2SLC1A1ALDH1A1MAPT
SCHEMBL1195466 0.75 SLC1A3 (0.39) SLC1A3SLC1A2SLC1A1ALDH1A1MAPT
SCHEMBL6675517 0.75 SLC1A3 (0.39) SLC1A3SLC1A2SLC1A1ALDH1A1MAPT
SCHEMBL4272520 0.72 ADH1B (0.34)
SCHEMBL17245264 0.69 MMP1 (0.43) SLC1A3SLC1A2SLC1A1ALDH1A1MAPT
SCHEMBL17245265 0.69 MMP1 (0.43) SLC1A3SLC1A2SLC1A1ALDH1A1MAPT

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-6344452-B1 GASTRIN RECEPTOR ANTAGONIST, GASTROINTESTINAL DISORDERS, ETC ZERIA PHARMACEUTICALS CO., LTD. (JP) 2002-02-05 US disclosed
EP-1085014-A1 1,5-BENZODIAZEPINE DERIVATIVES Zeria Pharmaceutical Co., Ltd. (JP) 2001-03-21 EP disclosed