SCHEMBL10403230

SCHEMBL10403230

Cc1nnc(SCCNC([O])=O)s1

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 4/20 0.54
▸ L3MBTL1 Q9Y468 1/20 0.54
▸ POLB P06746 1/20 0.47
▸ HTT P42858 1/20 0.47
▸ TSHR P16473 1/20 0.46
▸ ALDH1A1 P00352 6/20 0.46
▸ HPGD P15428 1/20 0.46
▸ NPC1 O15118 2/20 0.46
▸ RAB9A P51151 2/20 0.46
▸ MAPT P10636 3/20 0.45
▸ LMNA P02545 2/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ CYP1A2 P05177 1/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ HSD11B1 P28845 3/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43

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
SCHEMBL10403231 0.89 GAA (0.60) GAAL3MBTL1POLBHTTTSHR
SCHEMBL10404171 0.83 GAA (0.57) GAAL3MBTL1POLBHTTTSHR
SCHEMBL10402166 0.77 ALOX5 (0.39) GAAPOLBHTTALDH1A1NPC1
SCHEMBL13240158 0.76 GAA (0.59) GAAL3MBTL1POLBHTTALDH1A1
SCHEMBL10401908 0.76 KDM4E (0.41) POLBALDH1A1
SCHEMBL22051693 0.76 GAA (0.59) GAAL3MBTL1POLBHTTTSHR
SCHEMBL10404173 0.75 GAA (0.64) GAAL3MBTL1POLBHTTTSHR
SCHEMBL10402042 0.74 GAA (0.73) GAAL3MBTL1POLBHTTTSHR
SCHEMBL10404003 0.73 ALDH1A1 (0.37) L3MBTL1POLBHTTALDH1A1MAPT
SCHEMBL13471235 0.72 TSHR (0.56) GAAL3MBTL1POLBHTTTSHR

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
US-4914206-A ANTIBIOTICS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1990-04-03 — — US disclosed
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