SCHEMBL8411604

SCHEMBL8411604

O=C(O)COc1cccc2c(=O)c3ccccc3sc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 4/20 0.54
PTPN2 P17706 1/20 0.54
ALDH1A1 P00352 4/20 0.54
KDM4E B2RXH2 2/20 0.54
HPGD P15428 2/20 0.54
TDP1 Q9NUW8 1/20 0.54
L3MBTL1 Q9Y468 3/20 0.45
POLB P06746 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
GLA P06280 1/20 0.45
PTPRC P08575 1/20 0.44
PTPRF P10586 1/20 0.44
PTPRA P18433 1/20 0.44
PTPRB P23467 1/20 0.44
PTPN6 P29350 1/20 0.44
DUSP3 P51452 1/20 0.44
PTPN12 Q05209 1/20 0.44
PTGDR2 Q9Y5Y4 1/20 0.43
MAPT P10636 2/20 0.42
CASP1 P29466 1/20 0.42

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
SCHEMBL28670407 0.88 PTPN1 (0.41) PTPN1PTPN2ALDH1A1KDM4EHPGD
SCHEMBL20469835 0.84 PTPN2 (0.41) PTPN1PTPN2ALDH1A1KDM4EHPGD
SCHEMBL28997534 0.84 PTPN1 (0.50) PTPN1PTPN2ALDH1A1KDM4EHPGD
SCHEMBL29897738 0.83 HPGD (0.54) PTPN1PTPN2ALDH1A1KDM4EHPGD
SCHEMBL4634025 0.83 HPGD (0.54) PTPN1PTPN2ALDH1A1KDM4EHPGD
SCHEMBL20465959 0.83 F9 (0.42) PTPN1PTPN2ALDH1A1KDM4EHPGD
SCHEMBL12904681 0.83 CSF1R (0.52) PTPN1PTPN2ALDH1A1KDM4EHPGD
SCHEMBL6491767 0.82 PTPN1 (0.50) PTPN1PTPN2ALDH1A1KDM4EHPGD
SCHEMBL13066288 0.81 ALDH1A1 (0.52) PTPN1PTPN2ALDH1A1KDM4EHPGD
SCHEMBL21206920 0.81 MAPT (0.44) ALDH1A1KDM4EHPGDTDP1L3MBTL1

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
EP-0934247-A1 PHOTOINITIATORS Lambson Fine Chemicals Limited (GB) 1999-08-11 EP disclosed
WO-1997049664-A1 PHOTOINITIATORS LAMBSON FINE CHEMICALS LIMITED (GB) 1997-12-31 WO disclosed