SCHEMBL8401649

SCHEMBL8401649

CC(C)C[C@H](C(=O)N1CCN(S(=O)(=O)N(C)C)CC1)C1OC1(C(N)=O)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.38
ALDH1A1 P00352 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
LMNA P02545 1/20 0.33
CCR1 P32246 1/20 0.32
POLB P06746 1/20 0.32
MMP1 P03956 2/20 0.31
MMP2 P08253 2/20 0.31
MMP3 P08254 2/20 0.31
MMP8 P22894 2/20 0.31
KDM4E B2RXH2 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL8399823 0.78 GAA (0.48) GAASMN1; SMN2LMNACCR1POLB
Hydrochloric Acid SCHEMBL6988684 0.71 GAA (0.49) GAAALDH1A1L3MBTL1SMN1; SMN2POLB
SCHEMBL27475770 0.71 GAA (0.52) GAAALDH1A1L3MBTL1SMN1; SMN2LMNA
SCHEMBL6979222 0.68 CAPN1 (0.47) GAALMNAMAPT
SCHEMBL6981469 0.64 MAPK1 (0.48) GAAALDH1A1L3MBTL1LMNAMAPT
SCHEMBL6355903 0.61 ALDH1A1 (0.59) GAAALDH1A1L3MBTL1SMN1; SMN2POLB
SCHEMBL15808453 0.61 GAA (0.58) GAAALDH1A1L3MBTL1SMN1; SMN2POLB
SCHEMBL15808452 0.60 GAA (0.57) GAAALDH1A1L3MBTL1SMN1; SMN2LMNA
SCHEMBL8617486 0.60 CAPN1 (0.33) GAAALDH1A1L3MBTL1SMN1; SMN2LMNA
SCHEMBL14276864 0.59 GAA (0.61) GAAALDH1A1L3MBTL1SMN1; SMN2LMNA

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-5935959-A CYSTEINE PROTEASE INHIBITORS SENJU PHARMACEUTICAL CO., LTD. (JP) 1999-08-10 US disclosed