SCHEMBL693431

SCHEMBL693431

C[Zr](C)(=[SiH2])(C1C(CCc2ccccc2)=Cc2c(-c3cccc4ccccc34)ccc(-c3cccc4ccccc34)c21)C1C(CCc2ccccc2)=Cc2c(-c3cccc4ccccc34)ccc(-c3cccc4ccccc34)c21

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 1/20 0.30
CHRNB4 P30926 1/20 0.30
CHRNA3 P32297 1/20 0.30
CHRNA4 P43681 1/20 0.30
GPR52 Q9Y2T5 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
Hydrochloric Acid SCHEMBL720987 0.99
SCHEMBL694587 0.90
Hydrochloric Acid SCHEMBL716767 0.89
SCHEMBL696087 0.88 CNR1 (0.33)
Hydrochloric Acid SCHEMBL689433 0.87 CNR1 (0.33)
SCHEMBL694592 0.86 CNR1 (0.37)
SCHEMBL694455 0.86 HTR7 (0.31)
Hydrochloric Acid SCHEMBL691218 0.85 CNR1 (0.36)
SCHEMBL694722 0.85 CNR1 (0.41)
Hydrochloric Acid SCHEMBL689605 0.85 HTR7 (0.30)

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-2203486-B9 RACEMOSELECTIVE SYNTHESIS OF ANSA-METALLOCENE COMPOUNDS, ANSA-METALLOCENE COMPOUNDS, CATALYSTS COMPRISING THEM, PROCESS FOR PRODUCING AN OLEFIN POLYMER BY USE OF THE CATALYSTS, AND OLEFIN HOMO- AND COPOLYMERS LUMMUS NOVOLEN TECHNOLOGY GMBH (DE) 2012-08-01 EP claimed
EP-2203486-B1 RACEMOSELECTIVE SYNTHESIS OF ANSA-METALLOCENE COMPOUNDS, ANSA-METALLOCENE COMPOUNDS, CATALYSTS COMPRISING THEM, PROCESS FOR PRODUCING AN OLEFIN POLYMER BY USE OF THE CATALYSTS, AND OLEFIN HOMO- AND COPOLYMERS LUMMUS NOVOLEN TECHNOLOGY GMBH (DE) 2012-02-29 EP claimed