SCHEMBL8370659

SCHEMBL8370659

O=c1c2ccccc2sn1-c1c(F)cccc1F

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
G6PD P11413 6/20 0.71
MPI P34949 11/20 0.61
PHOSPHO1 Q8TCT1 9/20 0.61
PMM2 O15305 8/20 0.61
APOBEC3G Q9HC16 3/20 0.61
RAB9A P51151 2/20 0.61
KDM4E B2RXH2 2/20 0.59
ALDH1A1 P00352 2/20 0.59
MAPT P10636 2/20 0.59
PKM P14618 2/20 0.59
HPGD P15428 2/20 0.59
ALOX12 P18054 2/20 0.59
CASP3 P42574 2/20 0.59
NPSR1 Q6W5P4 2/20 0.59
TDP1 Q9NUW8 2/20 0.59
HSP90AA1 P07900 1/20 0.59
NPC1 O15118 1/20 0.53
TP53 P04637 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
KDM5B Q9UGL1 1/20 0.53

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
SCHEMBL8370684 0.84 MPI (0.63) G6PDMPIPHOSPHO1PMM2APOBEC3G
SCHEMBL8373417 0.83 G6PD (0.62) G6PDMPIPHOSPHO1PMM2APOBEC3G
SCHEMBL8373005 0.83 G6PD (1.00) G6PDMPIPHOSPHO1PMM2APOBEC3G
SCHEMBL8371739 0.79 MPI (0.62) G6PDMPIPHOSPHO1PMM2APOBEC3G
SCHEMBL8370675 0.79 MPI (0.61) G6PDMPIPHOSPHO1PMM2APOBEC3G
SCHEMBL8373412 0.77 G6PD (0.63) G6PDMPIPHOSPHO1PMM2APOBEC3G
SCHEMBL1894451 0.76 MPI (1.00) G6PDMPIPHOSPHO1PMM2APOBEC3G
SCHEMBL25763324 0.76 MPI (0.89) G6PDMPIPHOSPHO1PMM2APOBEC3G
SCHEMBL20022713 0.76 MPI (0.78) G6PDMPIPHOSPHO1PMM2APOBEC3G
SCHEMBL8369517 0.74 G6PD (0.72) G6PDMPIPHOSPHO1PMM2APOBEC3G

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022081984-A1 METHODS AND COMPOUNDS TO TREAT SARS INFECTIONS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2022-04-21 WO disclosed
EP-0644243-B1 Anti-fouling compositions or fouling control of harmful aquatic oranisms SUMITOMO CHEMICAL CO (JP) 1999-01-27 EP disclosed