SCHEMBL7935490

SCHEMBL7935490

C[Si](c1ccccc1)=[Hf](Cl)(Cl)(C1C=Cc2ccccc21)C1C=Cc2ccccc21

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.33
SIGMAR1 Q99720 2/20 0.31
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
THPO P40225 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
SCHEMBL4465783 0.85 HTR2A (0.35) HTR2ASIGMAR1
SCHEMBL1538530 0.83 HTR2A (0.36) HTR2ASIGMAR1KDM4ELMNATP53
SCHEMBL3383168 0.74 HTR2A (0.35) HTR2ASIGMAR1KDM4ELMNATP53
SCHEMBL8754995 0.74 HTR2A (0.34) HTR2ASIGMAR1KDM4ELMNATP53
SCHEMBL818471 0.73 HTR6 (0.33) HTR2ASIGMAR1KDM4ELMNATP53
SCHEMBL3383074 0.71 HTR6 (0.33) HTR2ASIGMAR1
SCHEMBL8755451 0.71 HTR2A (0.37) HTR2ASIGMAR1KDM4ELMNATP53
SCHEMBL7935464 0.71 HTR6 (0.31) HTR2A
SCHEMBL215792 0.71 HTR2A (0.35) HTR2A
SCHEMBL7951352 0.71 HTR2A (0.35) HTR2ASIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6184402-B1 RESOLUTION OF A STEREOISOMERIC MIXTURE OF SPECIFIC METALLOCENE COMPLEXES BRIDGED WITH A TRANSITION METAL HAVING AN OXYGEN BOND ATTACHED, I.E., A MU-OXO COMPLEX; HYDROLYSIS IN THE PRESENCE OF A BASE; SEPARATION OF MESO FORM FROM MIXES CHISSO CORPORATION (JP) 2001-02-06 US disclosed
EP-0708117-A1 Process for producing copolymer rubber SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1996-04-24 EP disclosed