SCHEMBL6252852

SCHEMBL6252852

C[Si]1(CC[Si]2(C)C(c3cccc(C#N)c3)=C(c3ccccc3)C(c3ccccc3)=C2c2cccc(C#N)c2)C(c2cccc(C#N)c2)=C(c2ccccc2)C(c2ccccc2)=C1c1cccc(C#N)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CLK4 Q9HAZ1 4/20 0.41
GABRG2 P18507 4/20 0.41
GABRB3 P28472 4/20 0.41
GABRA5 P31644 4/20 0.41
GABRA3 P34903 4/20 0.41
GABRA1 P14867 1/20 0.41
ADRA2C P18825 1/20 0.41
ADORA2A P29274 4/20 0.41
ADORA1 P30542 4/20 0.41
ADORA2B P29275 3/20 0.41
ALDH1A3 P47895 1/20 0.40
CYP1A2 P05177 4/20 0.39
ALDH1A1 P00352 3/20 0.39
CYP2C19 P33261 3/20 0.39
CYP3A4 P08684 3/20 0.39
TSHR P16473 3/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
MAPK1 P28482 2/20 0.39
HSD17B10 Q99714 2/20 0.39

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
SCHEMBL6256038 0.90 ADORA2A (0.43) CLK4GABRG2GABRB3GABRA5GABRA3
SCHEMBL6257635 0.86 CLK4 (0.45) CLK4GABRG2GABRB3GABRA5GABRA3
SCHEMBL6256345 0.84 TSHR (0.41) GABRG2GABRB3GABRA5GABRA3GABRA1
SCHEMBL6252571 0.82 ADORA2A (0.44) CLK4GABRG2GABRB3GABRA5GABRA3
SCHEMBL6257078 0.78 CLK4 (0.44) CLK4GABRG2GABRB3GABRA5GABRA3
SCHEMBL1054804 0.78 ALDH1A1 (0.35) ALDH1A1
SCHEMBL6257768 0.78 RAB9A (0.41) ADORA1CYP1A2ALDH1A1CYP2C19TSHR
SCHEMBL6253420 0.76 TAAR1 (0.39) ADORA2AADORA1ADORA2BCYP3A4
SCHEMBL6257016 0.75 GABRG2 (0.39) CLK4GABRG2GABRB3GABRA5GABRA3
SCHEMBL6252786 0.74 DYRK1A (0.42) CLK4ADRA2CADORA2ACYP1A2ALDH1A1

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-1143538-B1 Organic electroluminescent element containing a silacyclopentadiene derivative CHISSO CORP (JP) 2005-09-14 EP disclosed
EP-1143538-A1 Silacyclopentadiene derivatives and an organic electroluminescent element obtained by using the silacyclopentadiene derivative Chisso Corporation (JP) 2001-10-10 EP disclosed
US-6051319-A Silacyclopentadiene derivatives and an organic electroluminescent element obtained by using the silacyclopentadiene derivative CHISSO CORPORATION (JP) 2000-04-18 US disclosed
US-5986121-A Silacyclopentadiene derivatives and an organic electroluminescent element obtained by using the silacyclopentadiene derivative CHISSO CORPORATION (JP) 1999-11-16 US disclosed
EP-0754691-A2 Silacyclopentadiene derivatives and an organic electroluminescent element obtained by using the silacyclopentadiene derivative CHISSO CORPORATION (JP) 1997-01-22 EP disclosed