SCHEMBL5747752

SCHEMBL5747752

CCCCCCc1cc2cc(N)cc3ccc4cccc1c4c32

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 13/20 0.45
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
MAPT P10636 2/20 0.39
KDM4E B2RXH2 1/20 0.39
USP2 O75604 1/20 0.39
ALDH1A1 P00352 1/20 0.39
GLA P06280 1/20 0.39
CYP3A4 P08684 1/20 0.39
GAA P10253 1/20 0.39
HPGD P15428 1/20 0.39
CASP1 P29466 1/20 0.39
CASP7 P55210 1/20 0.39
HSD17B10 Q99714 1/20 0.39
PARP1 P09874 1/20 0.39
KCNH2 Q12809 2/20 0.37
ERBB2 P04626 1/20 0.37
CYP1A2 P05177 1/20 0.37
FYN P06241 1/20 0.37
MAOA P21397 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
SCHEMBL5748158 1.00 TLR8 (0.45) TLR8MEN1KMT2AMAPTKDM4E
SCHEMBL5749026 1.00 TLR8 (0.45) TLR8MEN1KMT2AMAPTKDM4E
SCHEMBL5746397 0.93 TLR8 (0.46) TLR8MEN1KMT2AMAPTKDM4E
SCHEMBL5746346 0.93 TLR8 (0.46) TLR8MEN1KMT2AMAPTKDM4E
SCHEMBL5748469 0.93 TLR8 (0.46) TLR8MEN1KMT2AMAPTKDM4E
SCHEMBL3747524 0.92 MEN1 (0.45) TLR8MEN1KMT2AMAPTKDM4E
Pyrene SCHEMBL4416467 0.92 MEN1 (0.45) TLR8MEN1KMT2AMAPTKDM4E
SCHEMBL8225761 0.90 MEN1 (0.46) TLR8MEN1KMT2AMAPTALDH1A1
SCHEMBL5750949 0.86 TLR8 (0.45) TLR8MEN1KMT2AMAPTKDM4E
SCHEMBL5748485 0.86 TLR8 (0.45) TLR8MEN1KMT2AMAPTKDM4E

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