SCHEMBL4464832

SCHEMBL4464832

CCCC(CCC1C=Cc2ccccc21)[Zr](Cl)(Cl)CC1C=Cc2ccccc21

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.36
SIGMAR1 Q99720 6/20 0.34

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
SCHEMBL4459358 0.91 HTR6 (0.37) HTR6SIGMAR1
SCHEMBL4469081 0.84 HTR6 (0.35) HTR6SIGMAR1
SCHEMBL4479878 0.83 HTR6 (0.38) HTR6SIGMAR1
SCHEMBL4471977 0.77 HTR6 (0.36) HTR6SIGMAR1
SCHEMBL4466026 0.76 HTR6 (0.39) HTR6SIGMAR1
Hydrochloric Acid SCHEMBL4479926 0.76 SIGMAR1 (0.34) HTR6SIGMAR1
SCHEMBL4462433 0.75 HTR6 (0.41) HTR6SIGMAR1
Hydrochloric Acid SCHEMBL4466028 0.74 HTR6 (0.40) HTR6SIGMAR1
SCHEMBL22452025 0.74 HTR6 (0.50) HTR6SIGMAR1
SCHEMBL29646288 0.74 HTR6 (0.50) HTR6SIGMAR1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1671983-B1 Catalysts compositions for the polymerization and copolymerization of alpha-olefins REPSOL QUIMICA SA (ES) 2009-02-25 EP claimed