SCHEMBL7934274

SCHEMBL7934274

CCCCC1=Cc2c(-c3c4ccccc4cc4ccccc34)cccc2C1[Zr](C1C(CCCC)=Cc2c(-c3c4ccccc4cc4ccccc34)cccc21)=[Si](C)C

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.31
HTR1A P08908 1/20 0.30
HTR7 P34969 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
SCHEMBL4659320 0.94 HTR1A (0.31) HTR1AHTR7
SCHEMBL7936720 0.89 CNR1 (0.31) CNR1
SCHEMBL7179766 0.88 CNR1 (0.34) CNR1HTR7
SCHEMBL27492035 0.88 CNR1 (0.32) CNR1HTR1AHTR7
SCHEMBL3120852 0.85 CNR1 (0.38) CNR1HTR7
SCHEMBL5981769 0.83 CNR2 (0.34)
SCHEMBL6754915 0.82 BCHE (0.31)
SCHEMBL27563784 0.81 HTR1A (0.33) HTR1AHTR7
SCHEMBL5982706 0.81 CES1 (0.34) HTR1AHTR7
Hydrochloric Acid SCHEMBL27479290 0.80 CNR1 (0.33) CNR1HTR1AHTR7

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
US-20010014718-A1 RESIN COMPOSITIONS AND USE OF THE SAME MITSUI CHEMICALS, INC. (JP) 2001-08-16 US disclosed