SCHEMBL5294263

SCHEMBL5294263

Cc1csc(Nc2nsc(S(=O)(=O)Cc3ccc4c(c3)OCO4)n2)n1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.46
KMT2A Q03164 3/20 0.43
LMNA P02545 6/20 0.43
RAB9A P51151 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
L3MBTL1 Q9Y468 3/20 0.42
MEN1 O00255 1/20 0.39
ROCK1 Q13464 1/20 0.38
KCNH2 Q12809 1/20 0.37
HSD17B10 Q99714 1/20 0.37
GAA P10253 1/20 0.37
PTGS2 P35354 1/20 0.36
TGFBR1 P36897 1/20 0.36

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
SCHEMBL5286204 0.86 KCNH2 (0.44) KMT2ALMNARAB9ASMN1; SMN2L3MBTL1
SCHEMBL5293214 0.82 HSD17B10 (0.40) KMT2ALMNARAB9AL3MBTL1MEN1
SCHEMBL5306349 0.74 ALDH1A1 (0.43) KMT2AMEN1HSD17B10GAA
SCHEMBL5293205 0.74 TAAR1 (0.43) KMT2ARAB9AMEN1HSD17B10GAA
SCHEMBL5357947 0.73 ALDH1A1 (0.39) NPC1KMT2ALMNARAB9ASMN1; SMN2
SCHEMBL5308656 0.70 MEN1 (0.42) KMT2ALMNAMEN1KCNH2HSD17B10
SCHEMBL5301071 0.68 CYP3A4 (0.42) KMT2ALMNAL3MBTL1MEN1HSD17B10
SCHEMBL3033576 0.64 KMT2A (0.54) NPC1KMT2ALMNARAB9ASMN1; SMN2
SCHEMBL924831 0.63 ALDH1A1 (0.54) SMN1; SMN2L3MBTL1HSD17B10GAA
SCHEMBL3339186 0.62 NPC1 (0.78) NPC1KMT2ALMNARAB9ASMN1; SMN2

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-2007012724-A1 1,2,4-THIADIAZOLE DERIVATIVES ANTIFUNGAL COMPOUNDS, COMPOSITIONS CONTAINING SAID COMPOUNDS AND THE USE THEREOF CYTOMICS SYSTEMS (FR) 2007-02-01 WO claimed