SCHEMBL3949562

SCHEMBL3949562

COc1cc(OC)c2sn(-c3ccccc3)c(=O)c2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MPI P34949 6/20 0.53
PMM2 O15305 5/20 0.53
MIF P14174 6/20 0.53
G6PD P11413 3/20 0.50
PHOSPHO1 Q8TCT1 6/20 0.46
APOBEC3G Q9HC16 3/20 0.46
MAPT P10636 2/20 0.46
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
HSP90AA1 P07900 1/20 0.46
PKM P14618 1/20 0.46
HPGD P15428 1/20 0.46
ALOX12 P18054 1/20 0.46
CASP3 P42574 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
KAT2B Q92831 3/20 0.46
TLR9 Q9NR96 1/20 0.43
MMP10 P09238 1/20 0.43
NPC1 O15118 1/20 0.43

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
SCHEMBL3953369 0.90 G6PD (0.55) MPIPMM2MIFG6PDPHOSPHO1
SCHEMBL8370750 0.84 MPI (0.52) MPIPMM2MIFG6PDPHOSPHO1
SCHEMBL8371737 0.82 MIF (0.59) MPIPMM2MIFG6PDPHOSPHO1
SCHEMBL8372534 0.77 MPI (0.72) MPIPMM2MIFG6PDPHOSPHO1
SCHEMBL8373532 0.74 MIF (0.74) MPIPMM2MIFG6PDPHOSPHO1
SCHEMBL8373420 0.72 G6PD (0.80) MPIPMM2MIFG6PDPHOSPHO1
SCHEMBL8371833 0.71 PHOSPHO1 (0.50) MPIPMM2MIFG6PDPHOSPHO1
SCHEMBL2538424 0.70 MPI (1.00) MPIPMM2MIFG6PDPHOSPHO1
SCHEMBL22092579 0.69 MIF (1.00) MPIPMM2MIFG6PDPHOSPHO1
SCHEMBL3947528 0.69 G6PD (0.50) 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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1655290-B1 Compositions comprising a benzoisothiazolone derivative and their use in the cosmetic field OREAL (FR) 2009-04-29 EP claimed
US-7232839-B2 Benzoisothiazolone compositions L'OREAL (FR) 2007-06-19 US claimed
US-20060142587-A1 Benzoisothiazolone compositions L'OREAL (FR) 2006-06-29 US claimed
EP-1655290-A1 Compositions comprising a benzoisothiazolone derivative and their use in the cosmetic field L'OREAL (FR) 2006-05-10 EP claimed
EP-1655290-B1 Compositions comprising a benzoisothiazolone derivative and their use in the cosmetic field OREAL (FR) 2009-04-29 EP disclosed
US-7232839-B2 Benzoisothiazolone compositions L'OREAL (FR) 2007-06-19 US disclosed
US-20060142587-A1 Benzoisothiazolone compositions L'OREAL (FR) 2006-06-29 US disclosed
EP-1655290-A1 Compositions comprising a benzoisothiazolone derivative and their use in the cosmetic field L'OREAL (FR) 2006-05-10 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060142587-A1 Benzoisothiazolone compositions COL1A1, TYR, CUTA MPI 3471/4885PMM2 4486/4885MIF 2178/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.