SCHEMBL5748271

SCHEMBL5748271

CCCCCCCCCCc1[c]c2ccccc2nc1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 6/20 0.48
KCNH2 Q12809 1/20 0.39
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
MAPT P10636 2/20 0.38
HPGD P15428 2/20 0.38
RAB9A P51151 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
NPC1 O15118 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
TRPV1 Q8NER1 4/20 0.38
MEN1 O00255 1/20 0.37
USP2 O75604 1/20 0.37
GAA P10253 1/20 0.37
KMT2A Q03164 1/20 0.37
HSD17B10 Q99714 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
SCHEMBL5749570 1.00 TLR7 (0.48) TLR7KCNH2KDM4EALDH1A1MAPT
SCHEMBL5747831 1.00 TLR7 (0.48) TLR7KCNH2KDM4EALDH1A1MAPT
SCHEMBL9870472 0.94 TLR7 (0.41) TLR7KDM4EALDH1A1MAPTHPGD
SCHEMBL9871357 0.87 PDE10A (0.40) TLR7KDM4EALDH1A1MAPTHPGD
SCHEMBL5748976 0.80 PDE10A (0.38) KDM4EALDH1A1MAPTHPGDRAB9A
SCHEMBL3670490 0.72 KCNH2 (0.42) KCNH2KDM4EALDH1A1MAPTRAB9A
SCHEMBL3670506 0.72 KCNH2 (0.42) KCNH2KDM4EALDH1A1MAPTRAB9A
SCHEMBL9145259 0.72 KCNH2 (0.42) KCNH2KDM4EALDH1A1MAPTRAB9A
SCHEMBL3671647 0.72 KCNH2 (0.42) KCNH2KDM4EALDH1A1MAPTRAB9A
SCHEMBL2460770 0.72 KCNH2 (0.42) KCNH2KDM4EALDH1A1MAPTRAB9A

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