SCHEMBL15531306

SCHEMBL15531306

CCCCCCCC[Sn](CCCCCCCC)(c1nccn1C)c1nccn1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 2/20 0.42
POLB P06746 3/20 0.41
ALDH1A1 P00352 1/20 0.41
KMT2A Q03164 1/20 0.41
TBXAS1 P24557 1/20 0.37
LPO P22079 1/20 0.35
TLR7 Q9NYK1 2/20 0.35
HTT P42858 5/20 0.33
NPC1 O15118 5/20 0.33
RAB9A P51151 5/20 0.33
GALR3 O60755 2/20 0.33
ATM Q13315 2/20 0.33
MAPK1 P28482 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
LMNA P02545 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
KDM4E B2RXH2 1/20 0.33
HSP90AA1 P07900 1/20 0.33
MAPT P10636 1/20 0.33
RAD52 P43351 1/20 0.33

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
SCHEMBL201430 0.78 KMT2A (0.43) TLR8POLBALDH1A1KMT2ATBXAS1
Decane SCHEMBL19922889 0.73 POLB (0.60) TLR8POLBALDH1A1KMT2ATBXAS1
Hexane SCHEMBL28888133 0.71 ALDH1A1 (0.62) TLR8POLBALDH1A1KMT2ATBXAS1
SCHEMBL1898631 0.70 TLR8 (0.44) TLR8POLBALDH1A1KMT2ATBXAS1
SCHEMBL2231125 0.70 TLR8 (0.44) TLR8POLBALDH1A1KMT2ATBXAS1
SCHEMBL2229133 0.70 TLR8 (0.44) TLR8POLBALDH1A1KMT2ATBXAS1
SCHEMBL4067299 0.70 TLR8 (0.44) TLR8POLBALDH1A1KMT2ATBXAS1
SCHEMBL301893 0.70 TLR8 (0.44) TLR8POLBALDH1A1KMT2ATBXAS1
SCHEMBL1526997 0.70 TLR8 (0.44) TLR8POLBALDH1A1KMT2ATBXAS1
SCHEMBL4060199 0.70 TLR8 (0.44) TLR8POLBALDH1A1KMT2ATBXAS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013167585-A2 RECYCLING OF ORGANOTIN COMPOUNDS UNIVERSITEIT ANTWERPEN (BE) 2013-11-14 WO disclosed