SCHEMBL7029033

SCHEMBL7029033

C[Si](C)=[Ti](C1C=Cc2ccccc21)C1C=Cc2ccccc21.c1ccc(CCc2ccccc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 6/20 0.38
HTR2A P28223 3/20 0.35
HTR6 P50406 1/20 0.35
KCNH2 Q12809 3/20 0.33
KDM4E B2RXH2 2/20 0.33
HRH1 P35367 2/20 0.33
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.33
CHRM2 P08172 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CHRM1 P11229 1/20 0.33
DRD2 P14416 1/20 0.33
ADRA2B P18089 1/20 0.33
ADRA2C P18825 1/20 0.33
NFKB1 P19838 1/20 0.33
CHRM3 P20309 1/20 0.33
SLC6A2 P23975 1/20 0.33
HTR2C P28335 1/20 0.33
ADRA1A P35348 1/20 0.33

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
SCHEMBL2534257 0.89 HTR2A (0.38) SIGMAR1HTR2AHTR6KCNH2KDM4E
SCHEMBL8755273 0.87 HTR2A (0.37) SIGMAR1HTR2AHTR6KCNH2KDM4E
Hydrochloric Acid SCHEMBL7643969 0.87 HTR2A (0.37) SIGMAR1HTR2AHTR6KCNH2KDM4E
Hydrochloric Acid SCHEMBL8754924 0.85 HTR2A (0.36) SIGMAR1HTR2AHTR6KCNH2KDM4E
SCHEMBL7029081 0.80 SIGMAR1 (0.38) SIGMAR1HTR2AHTR6KCNH2HSD17B10
SCHEMBL7634389 0.79 SIGMAR1 (0.39) SIGMAR1HTR2AHTR6KCNH2SMN1; SMN2
SCHEMBL7029036 0.79 SIGMAR1 (0.38) SIGMAR1HTR2AHTR6KCNH2SMN1; SMN2
SCHEMBL7029016 0.78 SIGMAR1 (0.32) SIGMAR1
SCHEMBL7109333 0.77 HTR2A (0.33) HTR2AKCNH2KDM4EHRH1LMNA
Hydrochloric Acid SCHEMBL8382252 0.76 KDM4E (0.35) HTR2AKCNH2KDM4EHRH1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0811628-B1 METHYLALUMINO-OXY COMPOUNDS AND CATALYSTS FOR THE PREPARATION O POLYMERS CONTAINING THE SAME IDEMITSU PETROCHEMICAL CO (JP) 2003-03-05 EP disclosed
US-6277934-B1 A SYNDIOTACTIC HOMO- OR COPOLYMER FROM A STYRENIC COMPOUND IN THE PRESENCE OF A METALLOCENE OF HIGH, STABLE ACTIVITY COMPRISING A TITANIUM COMPOUND AND AN ORGANIC ALUMINOXY COMPOUND OF SPECIFIC NUCLEAR MAGNETIC RESONANCE SPECTRUM IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2001-08-21 US disclosed
US-6034191-A Organic aluminoxy compound and catalyst for producing polymer IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2000-03-07 US disclosed
US-5917073-A Organic aluminoxy compound and catalyst for producing polymer IDEMITSU PETROCHEMICAL CO., LTD. (JP) 1999-06-29 US disclosed
EP-0811628-A1 ORGANIC ALUMINO-OXY COMPOUNDS AND CATALYSTS FOR THE PREPARATION O POLYMERS CONTAINING THE SAME IDEMITSU PETROCHEMICAL CO., LTD. (JP) 1997-12-10 EP disclosed