SCHEMBL5746397

SCHEMBL5746397

CCCCCCc1cc2cccc3ccc4cc(N)cc1c4c32

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 16/20 0.46
KCNH2 Q12809 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
KDM4E B2RXH2 1/20 0.38
USP2 O75604 1/20 0.38
ALDH1A1 P00352 1/20 0.38
GLA P06280 1/20 0.38
CYP3A4 P08684 1/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
CASP1 P29466 1/20 0.38
CASP7 P55210 1/20 0.38
HSD17B10 Q99714 1/20 0.38

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
SCHEMBL5748469 1.00 TLR8 (0.46) TLR8KCNH2MEN1KMT2AKDM4E
SCHEMBL5746346 1.00 TLR8 (0.46) TLR8KCNH2MEN1KMT2AKDM4E
SCHEMBL5749026 0.93 TLR8 (0.45) TLR8KCNH2MEN1KMT2AKDM4E
SCHEMBL5747752 0.93 TLR8 (0.45) TLR8KCNH2MEN1KMT2AKDM4E
SCHEMBL5748158 0.93 TLR8 (0.45) TLR8KCNH2MEN1KMT2AKDM4E
Pyrene SCHEMBL4416467 0.87 MEN1 (0.45) TLR8KCNH2MEN1KMT2AKDM4E
SCHEMBL3747524 0.87 MEN1 (0.45) TLR8KCNH2MEN1KMT2AKDM4E
SCHEMBL8225761 0.85 MEN1 (0.46) TLR8KCNH2MEN1KMT2AALDH1A1
SCHEMBL5749154 0.84 TLR8 (0.47) TLR8KCNH2MEN1KMT2AKDM4E
SCHEMBL5746168 0.84 TLR8 (0.47) TLR8KCNH2MEN1KMT2AKDM4E

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