SCHEMBL5688274

SCHEMBL5688274

CCCCC1=Cc2c(-c3cccc4ccccc34)cccc2C1[Zr](Cl)Cl

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.36
CNR2 P34972 2/20 0.35
TLR8 Q9NR97 1/20 0.33
ALOX15 P16050 4/20 0.33
HTR7 P34969 1/20 0.32
SLC6A4 P31645 2/20 0.32
DRD2 P14416 1/20 0.32
BCHE P06276 1/20 0.31
ACHE P22303 1/20 0.31
GUCY1A1 Q02108 1/20 0.30
GUCY1B1 Q02153 1/20 0.30

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
SCHEMBL27492404 0.96 CNR1 (0.40) CNR1CNR2TLR8ALOX15HTR7
SCHEMBL27594164 0.95 CNR1 (0.41) CNR1CNR2TLR8ALOX15HTR7
SCHEMBL7627579 0.93 SLC6A4 (0.33) CNR1CNR2TLR8ALOX15HTR7
SCHEMBL27612942 0.90 CNR1 (0.32) CNR1
SCHEMBL8158888 0.90 CNR1 (0.30) CNR1
SCHEMBL4065890 0.89 HTR7 (0.32) CNR1CNR2ALOX15HTR7SLC6A4
SCHEMBL27492035 0.87 CNR1 (0.32) CNR1HTR7
SCHEMBL7179766 0.87 CNR1 (0.34) CNR1CNR2TLR8ALOX15HTR7
SCHEMBL28576605 0.87 HPRT1 (0.33) CNR1SLC6A4DRD2
SCHEMBL27510576 0.87 CNR1 (0.33) CNR1TLR8

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-1065241-B1 Olefinic thermoplastic elastomer composition and method for producing the same MITSUI CHEMICALS INC (JP) 2006-04-05 EP disclosed
EP-1640415-A2 Olefinic thermoplastic elastomer composition and method for producing the same MITSUI CHEMICALS, INC. (JP) 2006-03-29 EP disclosed
CN-1616496-A Catalyst component, catalyst and process for ethylenically unsaturated monomer polymerization MITSUI CHEMICALS INC (JP) 2005-05-18 CN disclosed
CN-1224026-A Catalyst component for polymerizing ethylenically unsaturated monomers, catalyst and method of use thereof MITSUI CHEMICALS INC (JP) 1999-07-28 CN disclosed