SCHEMBL5749017

SCHEMBL5749017

CCCCCCCCc1cccc2ncc[c]c12

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 8/20 0.41
LIPG Q9Y5X9 1/20 0.41
KCNH2 Q12809 1/20 0.40
BID P55957 3/20 0.38
MCL1 Q07820 3/20 0.38
BCL2L1 Q07817 2/20 0.38
BAK1 Q16611 2/20 0.38
KAT8 Q9H7Z6 2/20 0.38
PPARG P37231 1/20 0.38
PPARA Q07869 1/20 0.38
EP300 Q09472 1/20 0.38
KAT2A Q92830 1/20 0.38
KAT2B Q92831 1/20 0.38
KAT5 Q92993 1/20 0.38
SAE1 Q9UBE0 1/20 0.38
ALOX5 P09917 1/20 0.37
PTGS2 P35354 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
SCHEMBL5751820 1.00 TLR8 (0.41) TLR8LIPGKCNH2BIDMCL1
SCHEMBL5750230 1.00 TLR8 (0.41) TLR8LIPGKCNH2BIDMCL1
SCHEMBL299975 0.98 TLR8 (0.40) TLR8LIPGKCNH2BIDMCL1
SCHEMBL5750628 0.77 LIPG (0.41) TLR8LIPGKCNH2BIDMCL1
SCHEMBL5749865 0.77 LIPG (0.41) TLR8LIPGKCNH2BIDMCL1
SCHEMBL5748220 0.77 LIPG (0.41) TLR8LIPGKCNH2BIDMCL1
SCHEMBL6114780 0.75 TLR8 (0.51) TLR8LIPGKCNH2BIDMCL1
SCHEMBL2251931 0.75 LIPG (0.45) TLR8LIPGKCNH2BIDMCL1
SCHEMBL11792004 0.75 TLR8 (0.45) TLR8LIPGKCNH2BIDMCL1
SCHEMBL6115265 0.75 TLR8 (0.51) TLR8LIPGKCNH2BIDMCL1

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
US-20060293503-A1 Polyaminopyridines and method for producing same SUMITOMO SEIKA CHEMICALS CO., LTD (JP) 2006-12-28 US disclosed
EP-1669390-A1 POLYAMINOPYRIDINES AND METHOD FOR PRODUCING SAME SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 2006-06-14 EP disclosed