SCHEMBL7457787

SCHEMBL7457787

O=C1NC(=O)C(COSCc2ccccc2)N1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.43
CRBN Q96SW2 2/20 0.38
DDB1 Q16531 1/20 0.38
HDAC8 Q9BY41 2/20 0.37
ADAMTS4 O75173 1/20 0.36
ADAMTS5 Q9UNA0 1/20 0.36
ALDH1A1 P00352 2/20 0.35
MEN1 O00255 1/20 0.35
CASP1 P29466 1/20 0.35
KMT2A Q03164 1/20 0.35
MAPT P10636 2/20 0.34
MAOB P27338 1/20 0.34
PLA2G10 O15496 1/20 0.34
PLA2G5 P39877 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
ATM Q13315 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33

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
SCHEMBL1011756 0.78 BCHE (0.50) GAAHDAC8ADAMTS4ADAMTS5ALDH1A1
SCHEMBL12946013 0.77 CRBN (0.51) GAACRBNDDB1HDAC8ADAMTS4
SCHEMBL6791929 0.77 CRBN (0.51) GAACRBNDDB1HDAC8ADAMTS4
SCHEMBL14357764 0.74 HDAC8 (0.57) GAACRBNDDB1HDAC8ADAMTS4
SCHEMBL1011632 0.74 HDAC8 (0.57) GAACRBNDDB1HDAC8ADAMTS4
SCHEMBL6515372 0.73 GAA (0.48) GAAADAMTS4ADAMTS5ALDH1A1MEN1
SCHEMBL15974260 0.71 GAA (0.49) GAAHDAC8ADAMTS4ADAMTS5ALDH1A1
SCHEMBL6791007 0.71 GAA (0.49) GAAHDAC8ADAMTS4ADAMTS5ALDH1A1
SCHEMBL1598100 0.70 CRBN (0.49) GAACRBNDDB1HDAC8ALDH1A1
SCHEMBL12258527 0.69 HDAC8 (0.47) GAAHDAC8ADAMTS4ADAMTS5ALDH1A1

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
EP-0718290-B1 Carboxyalkyl heterocyclic derivatives NIPPON ZOKI PHARMACEUTICAL CO (JP) 2002-04-17 EP disclosed
US-5912261-A ANTIDIABETIC AGENTS NIPPON ZOKI PHARMACEUTICAL CO., LTD. (JP) 1999-06-15 US disclosed
EP-0718290-A1 Carboxyalkyl heterocyclic derivatives NIPPON ZOKI PHARMACEUTICAL CO., LTD. (JP) 1996-06-26 EP disclosed