SCHEMBL8354538

SCHEMBL8354538

NCCCCc1nc2ccccc2cc1N

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 13/20 0.45
ALDH1A1 P00352 2/20 0.42
GLA P06280 2/20 0.42
HPGD P15428 2/20 0.42
KDM4E B2RXH2 1/20 0.42
NPC1 O15118 1/20 0.42
LMNA P02545 1/20 0.42
POLB P06746 1/20 0.42
GAA P10253 1/20 0.42
PTBP1 P26599 1/20 0.42
RAB9A P51151 1/20 0.42
KMT2A Q03164 1/20 0.42
RCE1 Q9Y256 1/20 0.42
MAPT P10636 2/20 0.41
ACHE P22303 1/20 0.41
MAOA P21397 1/20 0.40
HTR3A P46098 1/20 0.40
HRH1 P35367 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
SCHEMBL17713567 0.85 TLR8 (0.63) TLR8
SCHEMBL28743898 0.84 TLR8 (0.61) TLR8ALDH1A1GLAHPGDKDM4E
SCHEMBL287399 0.84 TLR8 (0.61) TLR8ALDH1A1GLAHPGDKDM4E
SCHEMBL27524779 0.83 TLR8 (0.62) TLR8ALDH1A1GLAHPGDKDM4E
SCHEMBL11829305 0.78 TLR8 (0.39) TLR8ALDH1A1GLAHPGDKDM4E
Acridine SCHEMBL27894463 0.78 MAPT (0.68) TLR8ALDH1A1GLAHPGDKDM4E
SCHEMBL28521043 0.77 TLR8 (0.56) TLR8
SCHEMBL31463622 0.77 PIK3CD (0.43) TLR8ALDH1A1GLAHPGDKDM4E
SCHEMBL3390064 0.77 PIK3CD (0.43) TLR8ALDH1A1GLAHPGDKDM4E
SCHEMBL18583409 0.75 ALDH1A1 (0.47) TLR8ALDH1A1GLAHPGDKDM4E

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1999021870-A1 ERYTHROMYCIN A 11, 12-CARBAMATE DERIVATIVES TAISHO PHARMACEUTICAL CO., LTD. (JP) 1999-05-06 WO disclosed