SCHEMBL6856381

SCHEMBL6856381

ClC(CC1C=Cc2ccccc21)C1C=Cc2ccccc21

nearest known ligand 0.44

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.44
HTR2A P28223 1/20 0.34
SIGMAR1 Q99720 4/20 0.32

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
SCHEMBL1644827 0.81 HTR2A (0.37) HTR6HTR2ASIGMAR1
SCHEMBL9226165 0.80 HTR6 (0.44) HTR6HTR2ASIGMAR1
SCHEMBL31124932 0.80 HTR6 (0.44) HTR6HTR2ASIGMAR1
SCHEMBL7208330 0.80 HTR6 (0.44) HTR6HTR2ASIGMAR1
SCHEMBL1539652 0.80 HTR6 (0.44) HTR6HTR2ASIGMAR1
SCHEMBL4447745 0.80 HTR6 (0.44) HTR6HTR2ASIGMAR1
SCHEMBL4803083 0.80 HTR6 (0.41) HTR6HTR2ASIGMAR1
SCHEMBL6912962 0.80 HTR6 (0.44) HTR6HTR2ASIGMAR1
SCHEMBL6911689 0.80 HTR6 (0.41) HTR6HTR2ASIGMAR1
SCHEMBL7204965 0.79 HTR6 (0.43) HTR6HTR2ASIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1388546-A2 Use of ionic compounds having a delocalised anionic charge as catalyst components ACEP INC. (CA) 2004-02-11 EP disclosed
EP-0928287-B1 IONIC COMPOUNDS WITH DELOCALIZED ANIONIC CHARGE, THEIR USE AS COMPONENTS OF IONIC CONDUCTORS OR CATALYST ACEP INC (CA) 2003-10-01 EP disclosed
EP-0850921-B1 Ionic conductive materials comprising an ionic compound, derived from malononitrile and uses thereof CENTRE NAT RECH SCIENT (FR) 2002-09-25 EP disclosed
EP-1201650-A2 Ionic malonitril derivatives and their uses CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2002-05-02 EP disclosed