SCHEMBL6946489

SCHEMBL6946489

C[C@H](CCC(N)=O)CNC(=O)OCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.50
CTSK P43235 3/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
LMNA P02545 1/20 0.49
SLC1A3 P43003 1/20 0.48
SLC1A1 P43005 1/20 0.48
PLAU P00749 1/20 0.47
CTSS P25774 1/20 0.46
SYK P43405 1/20 0.46

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
SCHEMBL6943807 1.00 HTT (0.50) HTTCTSKSMN1; SMN2LMNASLC1A3
SCHEMBL6404796 0.89 HTT (0.59) HTTCTSKSMN1; SMN2LMNACTSS
SCHEMBL6940690 0.89 HTT (0.59) HTTCTSKSMN1; SMN2LMNACTSS
SCHEMBL2722875 0.86 LMNA (0.51) HTTCTSKSMN1; SMN2LMNASLC1A3
SCHEMBL16828854 0.86 PSMB1 (0.53) HTTCTSKSMN1; SMN2LMNASLC1A3
SCHEMBL7533308 0.86 LMNA (0.51) HTTCTSKSMN1; SMN2LMNASLC1A3
SCHEMBL7535276 0.86 LMNA (0.51) HTTCTSKSMN1; SMN2LMNASLC1A3
SCHEMBL2723527 0.85 LMNA (0.52) HTTCTSKSMN1; SMN2LMNASLC1A3
SCHEMBL18086889 0.85 CTSK (0.55) HTTCTSKSMN1; SMN2LMNACTSS
SCHEMBL6943800 0.85 HSD17B10 (0.50) HTTCTSKSMN1; SMN2LMNACTSS

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
WO-2003103653-A1 METHODS OF TREATING ALZHEIMER'S DISEASE USING ARYL ALKANOIC ACID AMIDES ELAN PHARMACEUTICALS, INC. (US) 2003-12-18 WO disclosed