SCHEMBL9874972

SCHEMBL9874972

O=C(O)C(O)C1CCCN1C(=O)c1ccc(O)cc1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 3/20 0.47
GAA P10253 1/20 0.44
HPGD P15428 1/20 0.44
SLC6A1 P30531 2/20 0.43
CA2 P00918 1/20 0.42
ALDH1A1 P00352 1/20 0.40
NPSR1 Q6W5P4 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MGLL Q99685 1/20 0.38
HSP90AA1 P07900 1/20 0.38
HSP90AB1 P08238 1/20 0.38
PREP P48147 1/20 0.38

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
SCHEMBL9873876 1.00 HSD11B1 (0.47) HSD11B1GAAHPGDSLC6A1CA2
SCHEMBL9872319 0.88 SLC6A1 (0.54) GAAHPGDSLC6A1ALDH1A1L3MBTL1
SCHEMBL9872312 0.88 SLC6A1 (0.54) GAAHPGDSLC6A1ALDH1A1L3MBTL1
SCHEMBL9872741 0.87 GAA (0.47) GAAHPGDSLC6A1CA2ALDH1A1
SCHEMBL7844617 0.87 HSD11B1 (0.48) HSD11B1GAAHPGDSLC6A1CA2
SCHEMBL9872738 0.87 GAA (0.47) GAAHPGDSLC6A1CA2ALDH1A1
SCHEMBL9874471 0.87 HSD11B1 (0.46) HSD11B1GAAHPGDSLC6A1CA2
SCHEMBL9874467 0.87 HSD11B1 (0.46) HSD11B1GAAHPGDSLC6A1CA2
SCHEMBL9875176 0.84 ALDH1A1 (0.50) HSD11B1GAAHPGDALDH1A1NPSR1
SCHEMBL9875180 0.84 ALDH1A1 (0.50) HSD11B1GAAHPGDALDH1A1NPSR1

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
US-5051444-A Pyrrolidine derivatives as anti-amnesia agents SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1991-09-24 US disclosed
US-4880827-A Pyrrolidine derivatives having inhibitory action for proline specific endopepidase SUMITOMO PHARMACEUTICALS COMPANY, LTD. (JP) 1989-11-14 US disclosed
EP-0238319-A1 Pyrrolidine derivatives SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1987-09-23 EP disclosed