SCHEMBL6940690

SCHEMBL6940690

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

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.59
FOLH1 Q04609 6/20 0.54
LMNA P02545 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
CTSK P43235 3/20 0.48
CTSS P25774 2/20 0.48
SYK P43405 1/20 0.48
CTSL P07711 1/20 0.48
CTSB P07858 1/20 0.48

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
SCHEMBL6404796 1.00 HTT (0.59) HTTFOLH1LMNASMN1; SMN2CTSK
SCHEMBL6943807 0.89 HTT (0.50) HTTLMNASMN1; SMN2CTSKCTSS
SCHEMBL6946489 0.89 HTT (0.50) HTTLMNASMN1; SMN2CTSKCTSS
SCHEMBL2723527 0.87 LMNA (0.52) HTTLMNASMN1; SMN2CTSKCTSS
SCHEMBL18086889 0.87 CTSK (0.55) HTTLMNASMN1; SMN2CTSKCTSS
SCHEMBL6940875 0.87 HSD17B10 (0.50) HTTLMNASMN1; SMN2CTSKCTSS
SCHEMBL6943800 0.87 HSD17B10 (0.50) HTTLMNASMN1; SMN2CTSKCTSS
SCHEMBL7533308 0.86 LMNA (0.51) HTTLMNASMN1; SMN2CTSKCTSS
SCHEMBL7535276 0.86 LMNA (0.51) HTTLMNASMN1; SMN2CTSKCTSS
SCHEMBL2722875 0.86 LMNA (0.51) HTTLMNASMN1; SMN2CTSKCTSS

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