SCHEMBL11235274

SCHEMBL11235274

CCCCCCCCCCCCCc1c(N)ccc2ccccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 8/20 0.50
NCEH1 Q6PIU2 1/20 0.45
CNR1 P21554 2/20 0.44
MAPT P10636 2/20 0.43
KDM4E B2RXH2 3/20 0.42
NPC1 O15118 3/20 0.42
ALDH1A1 P00352 3/20 0.42
GAA P10253 3/20 0.42
HTT P42858 3/20 0.42
RAB9A P51151 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
NPSR1 Q6W5P4 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
LMNA P02545 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42
HPGD P15428 1/20 0.42
CYP2C19 P33261 1/20 0.42
MAPK1 P28482 1/20 0.42

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
SCHEMBL9655141 1.00 TLR8 (0.50) TLR8NCEH1CNR1MAPTKDM4E
SCHEMBL9653105 1.00 TLR8 (0.50) TLR8NCEH1CNR1MAPTKDM4E
SCHEMBL28963639 1.00 TLR8 (0.50) TLR8NCEH1CNR1MAPTKDM4E
SCHEMBL28965456 1.00 TLR8 (0.50) TLR8NCEH1CNR1MAPTKDM4E
SCHEMBL28963643 1.00 TLR8 (0.50) TLR8NCEH1CNR1MAPTKDM4E
SCHEMBL11129978 1.00 TLR8 (0.50) TLR8NCEH1CNR1MAPTKDM4E
SCHEMBL30287379 0.98 TLR8 (0.49) TLR8NCEH1CNR1MAPTKDM4E
SCHEMBL30287337 0.98 TLR8 (0.49) TLR8NCEH1CNR1MAPTKDM4E
SCHEMBL9723976 0.98 TLR8 (0.49) TLR8NCEH1CNR1MAPTKDM4E
SCHEMBL28633556 0.86 ALDH1A1 (0.48) TLR8NCEH1MAPTKDM4EALDH1A1

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
US-4315756-A Oil-soluble azo dye with N-substituted β-naphthylamine as coupling component BASF AKTIENGESELLSCHAFT (DE) 1982-02-16 US disclosed