SCHEMBL10345453

SCHEMBL10345453

COc1ccc(OCCSc2ccc(OCc3ccccc3)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
NPC1 O15118 1/20 0.55
TP53 P04637 1/20 0.55
RAB9A P51151 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
APP P05067 7/20 0.54
CHRNB2 P17787 1/20 0.52
CHRNB4 P30926 1/20 0.52
CHRNA3 P32297 1/20 0.52
CHRNA7 P36544 1/20 0.52
CHRNA4 P43681 1/20 0.52
MAOB P27338 1/20 0.51
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
BCHE P06276 1/20 0.51
MAPT P10636 1/20 0.50
HTT P42858 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
GAA P10253 1/20 0.49

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
SCHEMBL9770356 0.89 NPC1 (0.63) MAPK1SMN1; SMN2NPC1TP53RAB9A
SCHEMBL10598373 0.87 RAB9A (0.65) MAPK1SMN1; SMN2NPC1TP53RAB9A
SCHEMBL10345794 0.84 SMN1; SMN2 (0.58) MAPK1SMN1; SMN2NPC1TP53RAB9A
SCHEMBL791985 0.83 MAOB (0.69) SMN1; SMN2NPC1TP53RAB9AAPP
SCHEMBL5824912 0.81 NPC1 (0.57) MAPK1SMN1; SMN2NPC1TP53RAB9A
SCHEMBL7081506 0.80 ALDH1A1 (0.71) SMN1; SMN2NPC1RAB9AAPPMAOB
Benzylphenylether SCHEMBL28164613 0.80 MAOB (0.75) SMN1; SMN2NPC1TP53RAB9AAPP
SCHEMBL10345911 0.79 NPC1 (0.58) MAPK1SMN1; SMN2NPC1TP53RAB9A
SCHEMBL10345795 0.79 NPC1 (0.58) MAPK1SMN1; SMN2NPC1TP53RAB9A
SCHEMBL10346037 0.79 NPC1 (0.58) MAPK1SMN1; SMN2NPC1TP53RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0222343-B1 RECORDING MATERIAL FUJI PHOTO FILM CO., LTD. (JP) 1990-04-11 EP disclosed
US-4792542-A CONTAINING AN AROMATIC SULFIDE FUJI PHOTO FILM CO., LTD. (JP) 1988-12-20 US disclosed
EP-0222343-A2 Recording material FUJI PHOTO FILM CO., LTD. (JP) 1987-05-20 EP disclosed