SCHEMBL7602987

SCHEMBL7602987

C[Zr](C)(C1C=Cc2ccccc21)[Si]1([Zr](C)(C)C2C=Cc3ccccc32)CCCC1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
RET P07949 1/20 0.31
HTR6 P50406 1/20 0.30
HTR2A P28223 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
SCHEMBL797833 0.76 KDM4E (0.32) HTR2A
SCHEMBL3685967 0.75 HTR2A (0.38) RETHTR6HTR2A
SCHEMBL6857385 0.75 RET (0.38) RETHTR6HTR2A
SCHEMBL29697103 0.75 HTR2A (0.38) RETHTR6HTR2A
SCHEMBL29480066 0.75 RET (0.38) RETHTR6HTR2A
Hydrochloric Acid SCHEMBL30074160 0.73 HTR2A (0.37) RETHTR6HTR2A
Hydrochloric Acid SCHEMBL4457343 0.73 KDM4E (0.40) RETHTR6HTR2A
SCHEMBL8409887 0.72 RET (0.36) RETHTR6HTR2A
Ethylene SCHEMBL61250 0.72 HTR2A (0.36) RETHTR6HTR2A
SCHEMBL18952179 0.72 RET (0.36) RETHTR6HTR2A

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
US-6410665-B1 POLYMERIZATION COORDINATION CATALYST FOR ALPHA-OLEFIN BASELL POLYOLEFINE GMBH (DE) 2002-06-25 US claimed
US-6410665-B1 POLYMERIZATION COORDINATION CATALYST FOR ALPHA-OLEFIN BASELL POLYOLEFINE GMBH (DE) 2002-06-25 US disclosed