SCHEMBL13801587

SCHEMBL13801587

COc1ccc(Cc2ccc(Oc3ccc(-c4ccc(C)cc4)cc3)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.56
LTA4H P09960 3/20 0.55
MAPT P10636 2/20 0.54
MAPK1 P28482 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
ALOX5 P09917 2/20 0.52
MAOB P27338 2/20 0.50
IDH1 O75874 1/20 0.49
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.48
CYP17A1 P05093 1/20 0.47
EDNRA P25101 1/20 0.46
RELA Q04206 1/20 0.46

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
SCHEMBL13020514 1.00 ACHE (0.56) ACHELTA4HMAPTMAPK1L3MBTL1
SCHEMBL14826542 1.00 ACHE (0.56) ACHELTA4HMAPTMAPK1L3MBTL1
SCHEMBL13020525 1.00 ACHE (0.56) ACHELTA4HMAPTMAPK1L3MBTL1
SCHEMBL13508238 1.00 ACHE (0.56) ACHELTA4HMAPTMAPK1L3MBTL1
SCHEMBL13020524 1.00 ACHE (0.56) ACHELTA4HMAPTMAPK1L3MBTL1
SCHEMBL13020521 1.00 ACHE (0.56) ACHELTA4HMAPTMAPK1L3MBTL1
SCHEMBL12190468 0.94 ACHE (0.62) ACHELTA4HMAPTMAPK1L3MBTL1
SCHEMBL13508237 0.94 ACHE (0.62) ACHELTA4HMAPTMAPK1L3MBTL1
SCHEMBL12374454 0.94 ACHE (0.62) ACHELTA4HMAPTMAPK1L3MBTL1
SCHEMBL13079831 0.94 ACHE (0.62) ACHELTA4HMAPTMAPK1L3MBTL1

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-20180198149-A1 POLYPHENYLSULFONE-BASED PROTON CONDUCTING POLYMER ELECTROLYTE, PROTON CONDUCTING SOLID POLYMER ELECTROLYTE MEMBRANE, ELECTRODE CATALYST LAYER FOR SOLID POLYMER FUEL CELLS, METHOD FOR PRODUCING ELECTRODE CATALYST LAYER FOR SOLID POLYMER FUEL CELLS, AND FUEL CELL NATIONAL INSTITUTE FOR MATERIALS SCIENCE (JP) 2018-07-12 US disclosed
US-20090142569-A1 Optical elements composed of flame-resistant plastics SCHOTT AG (DE) 2009-06-04 US disclosed