SCHEMBL11569446

SCHEMBL11569446

CCSN(SCC)C(=S)N1C(=O)c2ccccc2C1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ASAH1 Q13510 1/20 0.39
DRD3 P35462 1/20 0.38
ALDH1A1 P00352 4/20 0.38
PLIN1 O60240 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
ALOX15 P16050 1/20 0.38
PLIN5 Q00G26 1/20 0.38
ABHD5 Q8WTS1 1/20 0.38
CES1 P23141 2/20 0.36
MEN1 O00255 1/20 0.36
GAA P10253 1/20 0.36
RAB9A P51151 1/20 0.36
KMT2A Q03164 1/20 0.36
PKM P14618 2/20 0.35
CA12 O43570 1/20 0.35
CA9 Q16790 1/20 0.35
RPS6KA2 Q15349 1/20 0.35
MAPK1 P28482 1/20 0.34
KDM4E B2RXH2 1/20 0.34

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
SCHEMBL11570214 0.81 ALDH1A1 (0.37) ASAH1DRD3ALDH1A1PLIN1MAPT
SCHEMBL4863625 0.69 ALDH1A1 (0.47) ASAH1ALDH1A1PLIN1MAPTHPGD
SCHEMBL11453040 0.69 MEN1 (0.36) ASAH1ALDH1A1CES1MEN1GAA
SCHEMBL6364894 0.67 CES1 (0.49) ASAH1DRD3ALDH1A1CES1MEN1
SCHEMBL11454100 0.67 CASP1 (0.35) ASAH1ALDH1A1MEN1GAARAB9A
SCHEMBL7335823 0.66 CES1 (0.66) ASAH1ALDH1A1CES1MEN1KMT2A
SCHEMBL3407687 0.65 CA12 (0.41) ASAH1ALDH1A1MAPTCES1MEN1
SCHEMBL9260578 0.65 ALDH1A1 (0.43) ALDH1A1CES1MEN1KMT2ACA9
SCHEMBL6553580 0.64 ALDH1A1 (0.50) ASAH1ALDH1A1HPGDCES1MEN1
SCHEMBL10351913 0.64 ALDH1A1 (0.43) DRD3ALDH1A1MAPTHPGDALOX15

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-0004711-A2 Process for the cross-linking of polymers Vulnax International Limited (GB) 1979-10-17 EP disclosed