SCHEMBL3624946

SCHEMBL3624946

C=Cc1ccc2cc3cc4cc(OCC)ccc4cc3cc2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RELA Q04206 1/20 0.47
ESR1 P03372 2/20 0.46
AHR P35869 1/20 0.46
NQO1 P15559 1/20 0.43
NPC1 O15118 2/20 0.43
MAPT P10636 2/20 0.43
RAB9A P51151 2/20 0.43
KDM4E B2RXH2 2/20 0.43
TUBB4A P04350 1/20 0.43
TUBB P07437 1/20 0.43
TUBA3C P0DPH7 1/20 0.43
TUBA1B P68363 1/20 0.43
TUBA4A P68366 1/20 0.43
TUBB4B P68371 1/20 0.43
TUBB3 Q13509 1/20 0.43
TUBB2A Q13885 1/20 0.43
TUBB8 Q3ZCM7 1/20 0.43
TUBA3E Q6PEY2 1/20 0.43
TUBA1A Q71U36 1/20 0.43
TUBA1C Q9BQE3 1/20 0.43

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
SCHEMBL3629029 1.00 RELA (0.47) RELAESR1AHRNQO1NPC1
SCHEMBL3625535 0.96 RELA (0.50) RELAESR1AHRNQO1NPC1
SCHEMBL283041 0.83 CHRNA7 (0.43) RELAESR1AHRNQO1NPC1
SCHEMBL23458226 0.83 NQO1 (0.62) RELANQO1NPC1MAPTKDM4E
SCHEMBL3901025 0.83 NCF1 (0.51) NPC1MAPTRAB9AKDM4EMAPK1
SCHEMBL3902755 0.82 NCF1 (0.54) AHRNPC1MAPTRAB9AKDM4E
SCHEMBL3618006 0.80 CYP1A2 (0.50) RELAESR1AHRRAB9AKDM4E
SCHEMBL3627666 0.80 CYP1A2 (0.50) RELAESR1AHRRAB9AKDM4E
SCHEMBL23636269 0.80 CYP1A2 (0.51) RELAESR1AHRKDM4ETUBB4A
SCHEMBL283100 0.79 TRPA1 (0.39) ESR1AHRMAPTTUBB4ATUBB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2506357-B1 Separation membrane for direct liquid fuel cell and method for producing same TOKUYAMA CORP (JP) 2015-06-17 EP disclosed
EP-2506357-A1 Separation membrane for direct liquid fuel cell and method for producing same Tokuyama Corporation (JP) 2012-10-03 EP disclosed
US-8232325-B2 Separation membrane for direct liquid fuel cell and method for producing same TOKUYAMA CORPORATION (JP) 2012-07-31 US disclosed
US-20100003574-A1 Separation Membrane for Direct Liquid Fuel Cell and Method for Producing Same TOKUYAMA CORPORATION (JP) 2010-01-07 US disclosed
EP-1990854-A1 SEPARATION MEMBRANE FOR DIRECT LIQUID FUEL CELL AND METHOD FOR PRODUCING SAME Tokuyama Corporation (JP) 2008-11-12 EP disclosed