SCHEMBL6242536

SCHEMBL6242536

COC(=O)c1ccc2c(c1)SN=CN2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 5/20 0.46
HSD17B10 Q99714 5/20 0.46
HTT P42858 4/20 0.46
MAPT P10636 4/20 0.46
HPGD P15428 3/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
MAPK1 P28482 2/20 0.46
FGB P02675 1/20 0.46
HSP90AA1 P07900 1/20 0.46
HSP90AB1 P08238 1/20 0.46
ALDH1A1 P00352 5/20 0.44
LMNA P02545 3/20 0.44
CA12 O43570 2/20 0.42
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
CA7 P43166 2/20 0.42
CA9 Q16790 2/20 0.42
CA14 Q9ULX7 2/20 0.42
XDH P47989 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
SCHEMBL6245050 0.78 LMNA (0.49) HTTMAPTHPGDMEN1KMT2A
SCHEMBL6252888 0.72 IMPDH2 (0.49) HSD17B10HPGDMAPK1ALDH1A1DYRK1A
SCHEMBL22226391 0.69 ALDH1A1 (0.51) ALOX15HSD17B10HTTMAPTHPGD
SCHEMBL6752502 0.69 MAPT (0.50) ALOX15HSD17B10HTTMAPTHPGD
SCHEMBL9508150 0.69 CA1 (0.55) ALOX15HSD17B10HTTMAPTHPGD
SCHEMBL69897 0.69 CA1 (0.55) ALOX15HSD17B10HTTMAPTHPGD
SCHEMBL6242539 0.68 CA12 (0.42) ALOX15HSD17B10HTTMAPTHPGD
SCHEMBL22226781 0.68 LMNA (0.82) ALOX15HSD17B10HTTMAPTHPGD
SCHEMBL5747335 0.68 ALDH1A1 (0.44) ALOX15HSD17B10HTTMAPTHPGD
SCHEMBL69025 0.67 PTPN11 (0.68) ALOX15HSD17B10HTTMAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1361873-A4 MATRIX METALLOPROTEINASE INHIBITORS WARNER LAMBERT CO (US) 2005-10-26 EP disclosed
EP-1361873-A2 MATRIX METALLOPROTEINASE INHIBITORS Warner-Lambert Company LLC (US) 2003-11-19 EP disclosed
WO-2002064080-A2 MATRIX METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY LCC (US) 2002-08-22 WO disclosed