SCHEMBL7607162

SCHEMBL7607162

C1=CC2=c3ccccc3=C(CC3c4ccccc4-c4ccccc43)C2C=C1.[Zr]

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.39
CA1 P00915 1/20 0.32
CA2 P00918 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
SCHEMBL7606245 0.97 HTR2A (0.39) HTR2ACA1CA2
Hydrochloric Acid SCHEMBL5353652 0.96 HTR2A (0.38) HTR2ACA1CA2
Hydrochloric Acid SCHEMBL5352121 0.96 HTR2A (0.38) HTR2ACA1CA2
Hydrochloric Acid SCHEMBL8677593 0.96 HTR2A (0.38) HTR2ACA1CA2
SCHEMBL6558691 0.86 HTR2A (0.33) HTR2A
SCHEMBL7605851 0.85 HTR2A (0.33) HTR2A
SCHEMBL7603806 0.83 HTR2A (0.33) HTR2A
SCHEMBL7609039 0.83 HTR2A (0.33) HTR2A
Hydrochloric Acid SCHEMBL5348066 0.82 HTR2A (0.33) HTR2A
Hydrochloric Acid SCHEMBL5357882 0.82 HTR2A (0.33) HTR2A

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-0524624-B1 Use of organometallic flurorenyl compounds. PHILLIPS PETROLEUM CO (US) 2002-05-15 EP claimed