SCHEMBL8677603

SCHEMBL8677603

CC=[Zr]CC(C1C=Cc2ccccc21)C1C=Cc2ccccc21

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.33
HTR2A P28223 2/20 0.33
SIGMAR1 Q99720 4/20 0.32
KDM4E B2RXH2 1/20 0.30
LMNA P02545 1/20 0.30
TP53 P04637 1/20 0.30
CHRM2 P08172 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
CHRM1 P11229 1/20 0.30
DRD2 P14416 1/20 0.30
ADRA2B P18089 1/20 0.30
ADRA2C P18825 1/20 0.30
NFKB1 P19838 1/20 0.30
CHRM3 P20309 1/20 0.30
SLC6A2 P23975 1/20 0.30
HTR2C P28335 1/20 0.30
ADRA1A P35348 1/20 0.30
HRH1 P35367 1/20 0.30
DRD3 P35462 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
SCHEMBL8384388 0.79 HTR6 (0.31) HTR6HTR2ASIGMAR1
SCHEMBL1921591 0.76 HTR2A (0.38) HTR6HTR2ASIGMAR1KDM4ELMNA
SCHEMBL939103 0.76 KDM4E (0.33) HTR6HTR2ASIGMAR1KDM4ELMNA
SCHEMBL9860034 0.75 HTR2A (0.37) HTR6HTR2ASIGMAR1KDM4ELMNA
SCHEMBL8380397 0.74 HTR6 (0.32) HTR6HTR2ASIGMAR1
SCHEMBL8384531 0.73 HTR2A (0.36) HTR6HTR2ASIGMAR1KDM4ELMNA
SCHEMBL6673086 0.73 HTR2A (0.36) HTR6HTR2ASIGMAR1KDM4ELMNA
SCHEMBL3383301 0.73 HTR2A (0.38) HTR6HTR2ASIGMAR1KDM4ELMNA
SCHEMBL3383305 0.73 HTR2A (0.38) HTR6HTR2ASIGMAR1KDM4ELMNA
SCHEMBL820676 0.73 HTR6 (0.34) HTR6HTR2ASIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5840815-A POLYMERIZING OLEFIN IN PRESENCE OF SOLID CATALYST FORMED FROM COMPOUND OF GROUP IVB METAL HAVING CYCLOPENTADIENE-BASED LIGANDS, ORGANOALUMINUM OXY-COMPOUND MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1998-11-24 US disclosed
EP-0406912-A2 Process for polymerizing olefins MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1991-01-09 EP disclosed
EP-0285443-A1 Process for producing solid catalyst for polymerization of olefins MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1988-10-05 EP disclosed