SCHEMBL4946259

SCHEMBL4946259

CC(C)S(=O)(=O)Nc1ccsc1-c1ccc(-c2cccc(C(=O)O)c2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACLY P53396 5/20 0.45
KMO O15229 1/20 0.43
LMNA P02545 1/20 0.41
GAA P10253 1/20 0.41
PFKFB3 Q16875 1/20 0.41
POLB P06746 1/20 0.41
MEN1 O00255 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
RXRA P19793 2/20 0.40
RXRB P28702 2/20 0.40
RXRG P48443 1/20 0.40
GRIA2 P42262 2/20 0.39
KCNH2 Q12809 1/20 0.39
ADAMTS4 O75173 1/20 0.39
GRIA4 P48058 1/20 0.39
FNTA P49354 1/20 0.38
FNTB P49356 1/20 0.38

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
SCHEMBL4953693 0.88 GRIA4 (0.49) ACLYRXRARXRBRXRGGRIA4
SCHEMBL4953413 0.85 PTGS2 (0.48) ACLYADAMTS4GRIA4
SCHEMBL4950027 0.84 TDP1 (0.39) ACLYGRIA4
SCHEMBL4950640 0.83 KDM4E (0.43) ACLYGAAPOLBGRIA4
SCHEMBL4950128 0.82 GRIA2 (0.52) MEN1KMT2AGRIA2KCNH2ADAMTS4
SCHEMBL4950718 0.82 RARB (0.41) GAAGRIA4
SCHEMBL27724208 0.81 ACLY (0.42) ACLY
SCHEMBL27703688 0.81 TTR (0.41) ACLYPOLBMEN1KMT2AGRIA4
SCHEMBL4945608 0.81 TDP1 (0.43) ACLYPOLBMEN1KMT2A
SCHEMBL4950817 0.81 PTGES2 (0.42) ACLY

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
EP-1893597-B1 AMPA RECEPTOR POTENTIATORS LILLY CO ELI (US) 2008-11-12 EP disclosed