SCHEMBL7586202

SCHEMBL7586202

CCCC[SiH](CCCC)[Hf](Cl)(Cl)(C1c2ccccc2-c2ccccc21)C1c2ccccc2-c2ccccc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.42
BCHE P06276 1/20 0.42
CHRM2 P08172 1/20 0.33
HTR1A P08908 1/20 0.33
ADRA2A P08913 1/20 0.33
CHRM1 P11229 1/20 0.33
DRD1 P21728 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
ADRA1A P35348 1/20 0.33
OPRM1 P35372 1/20 0.33
DRD3 P35462 1/20 0.33
SLC6A3 Q01959 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
SLC22A2 O15244 1/20 0.33
SLC22A3 O75751 1/20 0.33
CNR2 P34972 3/20 0.32
CNR1 P21554 1/20 0.32
GPR3 P46089 1/20 0.32
HTR2A P28223 1/20 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
SCHEMBL20972359 0.75 BCHE (0.38) ACHEBCHE
SCHEMBL6916550 0.73 GPR3 (0.39) ACHEBCHECHRM2HTR1AADRA2A
Hydrochloric Acid SCHEMBL7102554 0.68 ACHE (0.39) ACHEBCHECHRM2HTR1AADRA2A
SCHEMBL6905614 0.68 ACHE (0.42) ACHEBCHECHRM2HTR1AADRA2A
SCHEMBL6914409 0.67 GPR3 (0.32) SLC22A2SLC22A3GPR3HTR2AMEN1
Hydrochloric Acid SCHEMBL7101662 0.67 ACHE (0.37) ACHEBCHECHRM2HTR1AADRA2A
Hydrochloric Acid SCHEMBL7586204 0.67 ACHE (0.45) ACHEBCHECHRM2HTR1AADRA2A
SCHEMBL313685 0.65 ACHE (0.55) ACHEBCHECHRM2HTR1AADRA2A
SCHEMBL12537620 0.64
SCHEMBL877438 0.64 HTR2A (0.56) ACHEBCHEHTR2A

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-0729968-B1 Bridged bis-fluorenyl metallocenes, process for the preparation thereof and use thereof in catalysts for the polymerization of olefins BASELL POLYOLEFINE GMBH (DE) 2002-09-25 EP disclosed
EP-0729968-A1 Bridged bis-fluorenyl metallocenes, process for the preparation thereof and use thereof in catalysts for the polymerization of olefins Montell Technology Company bv (NL) 1996-09-04 EP disclosed