SCHEMBL8372534

SCHEMBL8372534

COc1ccc2sn(-c3ccccc3)c(=O)c2c1

nearest known ligand 0.72

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MPI P34949 6/20 0.72
PMM2 O15305 5/20 0.72
MIF P14174 6/20 0.69
G6PD P11413 7/20 0.68
PHOSPHO1 Q8TCT1 5/20 0.66
APOBEC3G Q9HC16 3/20 0.66
NPC1 O15118 1/20 0.66
RAB9A P51151 1/20 0.66
TLR9 Q9NR96 3/20 0.64
KDM4E B2RXH2 1/20 0.61
ALDH1A1 P00352 1/20 0.61
HSP90AA1 P07900 1/20 0.61
MAPT P10636 1/20 0.61
PKM P14618 1/20 0.61
HPGD P15428 1/20 0.61
ALOX12 P18054 1/20 0.61
CASP3 P42574 1/20 0.61
NPSR1 Q6W5P4 1/20 0.61
TDP1 Q9NUW8 1/20 0.61

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
SCHEMBL8373532 0.88 MIF (0.74) MPIPMM2MIFG6PDPHOSPHO1
SCHEMBL8371799 0.86 MPI (0.58) MPIPMM2MIFG6PDPHOSPHO1
SCHEMBL2538424 0.84 MPI (1.00) MPIPMM2MIFG6PDPHOSPHO1
SCHEMBL22092498 0.82 MIF (1.00) MPIPMM2MIFG6PDPHOSPHO1
SCHEMBL8370661 0.81 MPI (0.68) MPIPMM2MIFG6PDPHOSPHO1
SCHEMBL1897990 0.81 G6PD (1.00) MPIPMM2MIFG6PDPHOSPHO1
SCHEMBL7017590 0.81 MIF (0.61) MPIPMM2MIFG6PDPHOSPHO1
SCHEMBL8373420 0.80 G6PD (0.80) MPIPMM2MIFG6PDPHOSPHO1
SCHEMBL2535768 0.79 MPI (1.00) MPIPMM2MIFG6PDPHOSPHO1
SCHEMBL8369455 0.78 MIF (0.73) MPIPMM2MIFG6PDPHOSPHO1

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-0644243-B1 Anti-fouling compositions or fouling control of harmful aquatic oranisms SUMITOMO CHEMICAL CO (JP) 1999-01-27 EP disclosed