SCHEMBL8160283

SCHEMBL8160283

CCCCC1=CC([Zr](Cl)(Cl)(=C2CCCC2)C2C=C(CCCC)c3ccccc32)c2ccccc21

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.33
BCHE P06276 1/20 0.33
CNR1 P21554 1/20 0.32
CHRM2 P08172 1/20 0.31
HTR1A P08908 1/20 0.31
ADRA2A P08913 1/20 0.31
CHRM1 P11229 1/20 0.31
DRD1 P21728 1/20 0.31
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
ADRA1A P35348 1/20 0.31
OPRM1 P35372 1/20 0.31
DRD3 P35462 1/20 0.31
SLC6A3 Q01959 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31
HTR6 P50406 3/20 0.31
PTPN1 P18031 1/20 0.31

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
SCHEMBL8160249 0.99 ACHE (0.33) ACHEBCHECNR1CHRM2HTR1A
SCHEMBL8160717 0.96 CNR1 (0.36) ACHEBCHECNR1CHRM2HTR1A
SCHEMBL8161534 0.95 CNR1 (0.35) ACHEBCHECNR1CHRM2HTR1A
SCHEMBL8161472 0.82 BCHE (0.37) ACHEBCHECNR1HTR6PTPN1
SCHEMBL8160753 0.82 HTR6 (0.38) HTR6
SCHEMBL6062268 0.78 BCHE (0.35) ACHEBCHECNR1HTR6PTPN1
SCHEMBL8159433 0.78 BCHE (0.35) ACHEBCHECNR1HTR6PTPN1
SCHEMBL8160512 0.78 CNR1 (0.40) ACHEBCHECNR1HTR6PTPN1
SCHEMBL6403265 0.76 BCHE (0.31) ACHEBCHE
SCHEMBL6401830 0.75

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
EP-1017729-A2 PROCESS FOR THE PREPARATION OF SUBSTANTIALLY AMORPHOUS ALPHA-OLEFIN POLYMERS, COMPOSITIONS CONTAINING THEM AND PROCESS FOR THE PREPARATION OF BRIDGED LIGAND Montell Technology Company bv (NL) 2000-07-12 EP disclosed
WO-2000001738-A2 PROCESS FOR THE PREPARATION OF SUBSTANTIALLY AMORPHOUS ALPHA-OLEFIN POLYMERS, COMPOSITIONS CONTAINING THEM AND PROCESS FOR THE PREPARATION OF BRIDGED LIGAND MONTELL TECHNOLOGY COMPANY BV (NL) 2000-01-13 WO disclosed