SCHEMBL7367150

SCHEMBL7367150

CC(O)OC(=O)[C@@H](N)[C@@H](C)O

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 1/20 0.36
TSHR P16473 1/20 0.32
SLC1A3 P43003 1/20 0.31
SLC1A2 P43004 1/20 0.31
SLC1A1 P43005 1/20 0.31
DPP4 P27487 1/20 0.31
PREP P48147 1/20 0.31
DPP7 Q9UHL4 1/20 0.31
TP53 P04637 1/20 0.30

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
SCHEMBL11789459 0.84 TSHR (0.43) SLC7A5TSHRSLC1A3SLC1A2SLC1A1
SCHEMBL11789453 0.84 TSHR (0.43) SLC7A5TSHRSLC1A3SLC1A2SLC1A1
SCHEMBL28500308 0.84 TSHR (0.43) SLC7A5TSHRSLC1A3SLC1A2SLC1A1
SCHEMBL145865 0.84 SLC7A5 (0.48) SLC7A5TSHRSLC1A3SLC1A2SLC1A1
Hydrochloric Acid SCHEMBL18075258 0.82 TSHR (0.42) SLC7A5TSHRSLC1A3SLC1A2SLC1A1
Hydrochloric Acid SCHEMBL6386164 0.82 TSHR (0.42) SLC7A5TSHRSLC1A3SLC1A2SLC1A1
Hydrochloric Acid SCHEMBL18075227 0.82 TSHR (0.42) SLC7A5TSHRSLC1A3SLC1A2SLC1A1
Hydrochloric Acid SCHEMBL18075532 0.82 TSHR (0.42) SLC7A5TSHRSLC1A3SLC1A2SLC1A1
Hydrochloric Acid SCHEMBL18075618 0.82 TSHR (0.42) SLC7A5TSHRSLC1A3SLC1A2SLC1A1
SCHEMBL23541596 0.79

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6136580-A POLYPEPTIDE WITH ENZYMATIC ACTIVITY; FOR DIAGNOSIS, PREVENTION AND TREATMENT OF INFLAMMATION, TUMOR METASTASIS AND TISSUE REJECTION; ANTITUMOR AGENTS THE BURNHAM INSTITUTE (US) 2000-10-24 US disclosed
EP-0722321-A4 SULFOXIMINE AND SULFODIIMINE MATRIX METALLOPROTEINASE INHIBITORS UNIV FLORIDA STATE (US) 1998-04-15 EP disclosed
EP-0722436-A4 MERCAPTOSULFIDE METALLOPROTEINASE INHIBITORS UNIV FLORIDA STATE (US) 1996-11-20 EP disclosed
EP-0722321-A1 SULFOXIMINE AND SULFODIIMINE MATRIX METALLOPROTEINASE INHIBITORS FLORIDA STATE UNIVERSITY (US) 1996-07-24 EP disclosed
EP-0722436-A1 MERCAPTOSULFIDE METALLOPROTEINASE INHIBITORS FLORIDA STATE UNIVERSITY (US) 1996-07-24 EP disclosed
WO-1995009833-A1 MERCAPTOSULFIDE METALLOPROTEINASE INHIBITORS FLORIDA STATE UNIVERSITY (US) 1995-04-13 WO disclosed
WO-1995009620-A1 SULFOXIMINE AND SULFODIIMINE MATRIX METALLOPROTEINASE INHIBITORS FLORIDA STATE UNIVERSITY (US) 1995-04-13 WO disclosed