SCHEMBL7544944

SCHEMBL7544944

CCC1=CC([Si](C)(C)C2c3ccccc3-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
GPR3 P46089 1/20 0.32
HTR2A P28223 1/20 0.32
CHRM2 P08172 1/20 0.30
HTR1A P08908 1/20 0.30
ADRA2A P08913 1/20 0.30
CHRM1 P11229 1/20 0.30
DRD1 P21728 1/20 0.30
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30
ADRA1A P35348 1/20 0.30
OPRM1 P35372 1/20 0.30
DRD3 P35462 1/20 0.30
SLC6A3 Q01959 1/20 0.30
HRH3 Q9Y5N1 1/20 0.30
HTR6 P50406 2/20 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
SCHEMBL8466889 0.83 TOP2A (0.32)
SCHEMBL8468840 0.83 HTR6 (0.39) HTR6
SCHEMBL7546253 0.82
Hydrochloric Acid SCHEMBL8680298 0.81 TOP2A (0.30)
SCHEMBL7944622 0.78 GPR3 (0.34) GPR3HTR2A
SCHEMBL30143298 0.77 HTR6 (0.37) ACHEBCHEHTR6
SCHEMBL19901173 0.74 ACHE (0.39) ACHEBCHECHRM2HTR1AADRA2A
SCHEMBL5175634 0.74 GPR3 (0.46) ACHEBCHEGPR3HTR2ACHRM2
SCHEMBL21035817 0.73 BCHE (0.33) ACHEBCHEHTR6
Hydrochloric Acid SCHEMBL6559588 0.70 GPR3 (0.43) ACHEBCHEGPR3HTR2ACHRM2

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-0693497-B1 Process for the preparation of silicon-bridged asymmetric cyclopentadienyl-, indenyl- and fluorenyl-containing ligand systems BOREALIS TECH OY (FI) 2002-06-12 EP disclosed
EP-0693497-A2 Process for the preparation of silicon-bridged asymmetric cyclopentadienyl-, indenyl- and fluorenyl-containing ligand systems PCD-Polymere Gesellschaft m.b.H. (AT) 1996-01-24 EP disclosed