SCHEMBL9017764

SCHEMBL9017764

CCCCSc1cccc2cc3cccc(SCCCC)c3cc12

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 1/20 0.49
PTGS2 P35354 6/20 0.44
NPC1 O15118 3/20 0.37
RAB9A P51151 2/20 0.37
MAPT P10636 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
ALDH1A1 P00352 1/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
ATM Q13315 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
CNR2 P34972 1/20 0.35
LMNA P02545 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
HASPIN Q8TF76 1/20 0.35
S100A4 P26447 1/20 0.34
SOAT1 P35610 1/20 0.34

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
SCHEMBL9850477 0.88 PTGS2 (0.46) TLR8PTGS2MAPTCNR2SOAT1
SCHEMBL2607673 0.84 TLR8 (0.50) TLR8PTGS2NPC1RAB9AMAPT
SCHEMBL348041 0.83 PTGS2 (0.50) TLR8PTGS2NPC1RAB9AMAPT
SCHEMBL6835641 0.82 PTGS2 (0.41) TLR8PTGS2RAB9AMAPTALDH1A1
SCHEMBL9519759 0.79 TLR8 (0.49) TLR8PTGS2NPC1RAB9AMAPT
SCHEMBL16519472 0.79 PTGS2 (0.51) TLR8PTGS2NPC1RAB9AMAPT
SCHEMBL30417186 0.79 PTGS2 (0.49) TLR8PTGS2MAPTNPSR1ALDH1A1
SCHEMBL18758015 0.79 PTGS2 (0.49) TLR8PTGS2MAPTNPSR1ALDH1A1
SCHEMBL8007364 0.78 MEN1 (0.53) TLR8PTGS2NPC1RAB9AMAPT
SCHEMBL25738323 0.77 PTGS2 (0.50) TLR8PTGS2NPC1RAB9ANPSR1

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-5501821-A OPTICAL ARTICLES FOR TRANSMISSION OF ELECTROMAGNETIC WAVES WITH DIPOLES EASTMAN KODAK COMPANY (US) 1996-03-26 US disclosed