SCHEMBL5746387

SCHEMBL5746387

CCCCCCCCc1cccc2cc3c(N)cccc3cc12

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 11/20 0.52
PARP1 P09874 1/20 0.49
LIPG Q9Y5X9 1/20 0.42
KCNH2 Q12809 1/20 0.42
MAPT P10636 2/20 0.41
KDM4E B2RXH2 1/20 0.40
USP2 O75604 1/20 0.40
ALDH1A1 P00352 1/20 0.40
GLA P06280 1/20 0.40
CYP3A4 P08684 1/20 0.40
GAA P10253 1/20 0.40
HPGD P15428 1/20 0.40
CASP1 P29466 1/20 0.40
CASP7 P55210 1/20 0.40
HSD17B10 Q99714 1/20 0.40
BID P55957 2/20 0.40
BCL2L1 Q07817 2/20 0.40
MCL1 Q07820 2/20 0.40
BAK1 Q16611 2/20 0.40

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
SCHEMBL5747866 1.00 TLR8 (0.52) TLR8PARP1LIPGKCNH2MAPT
SCHEMBL5747159 1.00 TLR8 (0.52) TLR8PARP1LIPGKCNH2MAPT
SCHEMBL5747890 0.95 TLR8 (0.51) TLR8PARP1LIPGKCNH2MAPT
SCHEMBL5747569 0.95 TLR8 (0.51) TLR8PARP1LIPGKCNH2MAPT
SCHEMBL5748722 0.95 TLR8 (0.51) TLR8PARP1LIPGKCNH2MAPT
SCHEMBL1611673 0.85 LIPG (0.50) TLR8LIPGKCNH2MAPTBID
SCHEMBL1610855 0.85 LIPG (0.50) TLR8LIPGKCNH2MAPTBID
SCHEMBL1612051 0.85 LIPG (0.50) TLR8LIPGKCNH2MAPTBID
SCHEMBL27774569 0.85 LIPG (0.50) TLR8LIPGKCNH2MAPTBID
SCHEMBL9394658 0.85 LIPG (0.50) TLR8LIPGKCNH2MAPTBID

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