SCHEMBL7632629

SCHEMBL7632629

CCCC[Zr](CCCC)C1C=Cc2c(-c3ccccc3)cccc21

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SOAT1 P35610 2/20 0.34
BCHE P06276 1/20 0.34
ACHE P22303 1/20 0.34
KDM4E B2RXH2 1/20 0.32
DRD2 P14416 1/20 0.31
HTR7 P34969 1/20 0.31

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
SCHEMBL8898962 0.80 PDCD1 (0.33)
SCHEMBL28814578 0.78 CHRNB2 (0.33) HTR7
SCHEMBL7203760 0.77 PDCD1 (0.30)
SCHEMBL5183957 0.76 CHRNB2 (0.34)
SCHEMBL7629217 0.75 SIGMAR1 (0.36) BCHEACHEKDM4EDRD2
SCHEMBL3685422 0.75 CYP2A6 (0.34)
SCHEMBL7624920 0.75 BCHE (0.33) SOAT1BCHEACHEKDM4EDRD2
SCHEMBL7203992 0.74 CHRNB2 (0.31)
Hydrochloric Acid SCHEMBL3181895 0.73 CHRNB2 (0.31)
SCHEMBL7625956 0.73 BCHE (0.34) SOAT1BCHEACHEKDM4E

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-1219657-A1 POLYARYLENE AND METHOD FOR PRODUCTION THEREOF Japan Science and Technology Corporation (JP) 2002-07-03 EP disclosed