SCHEMBL175529

SCHEMBL175529

CCCCn1c(=O)c2sc3c(=O)[nH]c(=O)c3sc2c1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
MAPT P10636 1/20 0.41
ATM Q13315 1/20 0.41
RGS4 P49798 4/20 0.41
KDM4E B2RXH2 3/20 0.39
GAA P10253 2/20 0.39
ALDH1A1 P00352 2/20 0.39
RGS8 P57771 2/20 0.39
GSK3B P49841 1/20 0.39
PDE4A P27815 2/20 0.38
ADORA2A P29274 2/20 0.38
PDE4B Q07343 2/20 0.38
PDE4C Q08493 2/20 0.38
PDE4D Q08499 2/20 0.38
ADORA3 P0DMS8 1/20 0.38
ADORA2B P29275 1/20 0.38
LMNA P02545 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL1074421 0.83 L3MBTL1 (0.46) TDP1L3MBTL1RGS4ALDH1A1RGS8
SCHEMBL1729815 0.81 HTT (0.42) L3MBTL1MAPTALDH1A1GSK3BPDE4A
SCHEMBL175121 0.76 GSK3A (0.38) TDP1L3MBTL1RGS4KDM4EALDH1A1
SCHEMBL17108478 0.74 GSK3A (0.31) GSK3B
SCHEMBL1074044 0.67 GSK3B (0.39) L3MBTL1GSK3BPDE4BADORA2BLMNA
SCHEMBL11637084 0.65 MAPT (0.53) MAPTATMRGS4KDM4EGAA
SCHEMBL8777494 0.65 TDP1 (0.68) TDP1L3MBTL1RGS4GAAALDH1A1
SCHEMBL2784423 0.65 ATM (0.53) TDP1L3MBTL1MAPTATMRGS4
SCHEMBL1729644 0.64 ADORA2B (0.40) L3MBTL1MAPTATMKDM4EGAA
SCHEMBL1729797 0.64 FABP4 (0.44) MAPTKDM4ELMNA

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-2611814-A1 METHOD FOR PRODUCING DITHIIN-TETRACARBOXIMIDES Bayer Intellectual Property GmbH (DE) 2013-07-10 EP disclosed
WO-2012028588-A1 METHOD FOR PRODUCING DITHIIN-TETRACARBOXIMIDES BAYER CROPSCIENCE AG (DE) 2012-03-08 WO disclosed