SCHEMBL5618482

SCHEMBL5618482

NC(=O)NC1=CCSC=C1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
GFER P55789 1/20 0.32
PEPD P12955 1/20 0.31
NPC1 O15118 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL18726609 0.68 GAA (0.34) GAAMAPTGFERPEPDNPC1
SCHEMBL30398963 0.65 GAA (0.32) GAAMAPTGFERPEPDNPC1
SCHEMBL28483958 0.60
SCHEMBL28816279 0.60
SCHEMBL30047240 0.57
SCHEMBL3928666 0.54 GAA (0.67) GAAMAPTGFERPEPDNPC1
SCHEMBL29840068 0.54 GAA (0.67) GAAMAPTGFERPEPDNPC1
SCHEMBL5062623 0.54 PEPD (0.80) GAAMAPTGFERPEPDNPC1
SCHEMBL1787750 0.54 PEPD (0.56) GAAMAPTGFERPEPDNPC1
SCHEMBL7417077 0.53 GAA (0.57) GAAMAPTGFERPEPDNPC1

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-7157457-B2 Compounds useful in the treatment of inflammatory diseases GLAXO GROUP LIMITED (GB) 2007-01-02 US disclosed