SCHEMBL10820880

SCHEMBL10820880

O=S(=S)(Oc1nsc2ccccc12)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.39
▸ HSD17B10 Q99714 2/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ MAPT P10636 2/20 0.39
▸ EPAS1 Q99814 7/20 0.37
▸ HTR6 P50406 3/20 0.34
▸ DRD2 P14416 2/20 0.34
▸ HTR2A P28223 2/20 0.34
▸ HTR7 P34969 2/20 0.34
▸ HTR1A P08908 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.32
▸ ACACB O00763 1/20 0.31
▸ ABCC9 O60706 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ SMN1; SMN2 Q16637 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
SCHEMBL3987910 0.78 MAPT (0.43) ALDH1A1HSD17B10KDM4EMAPTEPAS1
SCHEMBL291757 0.77 KDM4E (0.40) ALDH1A1HSD17B10KDM4EMAPTEPAS1
SCHEMBL1600542 0.70 KDM4E (0.54) ALDH1A1HSD17B10KDM4EMAPTEPAS1
SCHEMBL8140189 0.68 EPAS1 (0.50) ALDH1A1HSD17B10KDM4EMAPTEPAS1
SCHEMBL28227860 0.67 KDM4E (0.46) ALDH1A1HSD17B10KDM4EMAPTEPAS1
SCHEMBL4821823 0.67 CA1 (0.52) ALDH1A1HSD17B10MAPTHTR6TDP1
SCHEMBL13606252 0.66 PTPN2 (0.47) ALDH1A1HSD17B10KDM4EMAPTEPAS1
SCHEMBL10820879 0.66 ALDH1A1 (0.41) ALDH1A1HSD17B10KDM4EMAPTEPAS1
SCHEMBL6649278 0.64 HTR6 (0.50) ALDH1A1HSD17B10HTR6TDP1SMN1; SMN2
SCHEMBL7812112 0.64 MAPT (0.46) ALDH1A1HSD17B10KDM4EMAPTEPAS1

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-4609438-A ELECTROLYTIC, FROM A 2-MERCAPTOBENZOTHIAZOLE AND A BENZENESULFINATE OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 1986-09-02 — — US disclosed
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