SCHEMBL6252571

SCHEMBL6252571

CC[Si]1(CC)C(c2cccc(C#N)c2)=C(c2ccccc2)C(c2ccccc2)=C1c1cccc(C#N)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 4/20 0.44
ADORA1 P30542 3/20 0.44
ADORA2B P29275 2/20 0.44
GABRG2 P18507 4/20 0.43
GABRB3 P28472 4/20 0.43
GABRA5 P31644 4/20 0.43
GABRA3 P34903 4/20 0.43
CLK4 Q9HAZ1 3/20 0.41
GABRA1 P14867 1/20 0.41
ADRA2C P18825 1/20 0.41
CTSS P25774 1/20 0.41
CTSK P43235 1/20 0.41
IDO1 P14902 1/20 0.40
ALDH1A3 P47895 1/20 0.40
MEN1 O00255 2/20 0.39
ALDH1A1 P00352 2/20 0.39
CYP1A2 P05177 2/20 0.39
CYP3A4 P08684 2/20 0.39
CYP2C19 P33261 2/20 0.39
KMT2A Q03164 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 0.87 ADORA2A (0.43) ADORA2AADORA1ADORA2BGABRG2GABRB3
SCHEMBL6255448 0.84 TSHR (0.41) GABRG2GABRB3GABRA5GABRA3GABRA1
SCHEMBL6257635 0.83 CLK4 (0.45) ADORA2AADORA1ADORA2BGABRG2GABRB3
SCHEMBL6252852 0.82 CLK4 (0.41) ADORA2AADORA1ADORA2BGABRG2GABRB3
SCHEMBL6257078 0.78 CLK4 (0.44) ADORA2AADORA1ADORA2BGABRG2GABRB3
SCHEMBL6253373 0.78 ALDH1A1 (0.35) ALDH1A1KMT2A
SCHEMBL6254883 0.78 RAB9A (0.41) MEN1ALDH1A1KMT2ATSHRMAPK1
SCHEMBL6257029 0.76 TAAR1 (0.39) ADORA2AIDO1ALDH1A1LMNAHSD17B10
SCHEMBL6257016 0.75 GABRG2 (0.39) ADORA2AADORA1ADORA2BGABRG2GABRB3
SCHEMBL10018833 0.75 SMN1; SMN2 (0.38) ALDH1A1CYP1A2CYP3A4MAPK1LMNA

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 6 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-0754691-B1 Silacyclopentadiene derivatives and an organic electroluminescent element obtained by using the silacyclopentadiene derivative CHISSO CORP (JP) 2003-11-19 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