SCHEMBL6253585

SCHEMBL6253585

CC[Si]1(CC)C(c2ccc(-c3cccc4ccccc34)nc2)=C(c2ccccc2)C(c2ccccc2)=C1c1ccc(-c2cccc3ccccc23)nc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 3/20 0.40
CYP11B2 P19099 3/20 0.40
MAPK1 P28482 2/20 0.38
MAPK3 P27361 1/20 0.38
PTPN11 Q06124 1/20 0.38
KDM4E B2RXH2 2/20 0.37
ALDH1A1 P00352 2/20 0.37
HPGD P15428 2/20 0.37
ATR Q13535 1/20 0.37
HTR2C P28335 3/20 0.36
ENPP1 P22413 2/20 0.36
ENPP3 O14638 1/20 0.35
GSK3A P49840 1/20 0.35
GSK3B P49841 1/20 0.35
TP53 P04637 1/20 0.35
MAPT P10636 1/20 0.35
TSHR P16473 1/20 0.35
NFKB1 P19838 1/20 0.35
NFKB2 Q00653 1/20 0.35
RELA Q04206 1/20 0.35

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
SCHEMBL6257471 0.89 CYP11B1 (0.39) CYP11B1CYP11B2MAPK1MAPK3PTPN11
SCHEMBL6253456 0.86 CYP11B1 (0.40) CYP11B1CYP11B2MAPK1MAPK3PTPN11
SCHEMBL6254611 0.83 HPGDS (0.45) CYP11B1CYP11B2TP53SMN1; SMN2
SCHEMBL6254506 0.82 ALDH1A1 (0.40) MAPK1MAPK3PTPN11KDM4EALDH1A1
SCHEMBL6252141 0.81 ALDH1A1 (0.40) MAPK1KDM4EALDH1A1HPGDENPP1
SCHEMBL6257000 0.80 CYP11B1 (0.36) CYP11B1CYP11B2MAPK1MAPK3PTPN11
SCHEMBL6256051 0.80 CYP11B1 (0.41) CYP11B1CYP11B2KDM4EALDH1A1HPGD
SCHEMBL13979742 0.75 CYP11B1 (0.49) CYP11B1CYP11B2KDM4EALDH1A1HPGD
SCHEMBL12435976 0.74 CYP11B1 (0.44) CYP11B1CYP11B2MAPK1KDM4EALDH1A1
SCHEMBL6256305 0.74 HPGDS (0.38) HPGDMAPTNFKB1NFKB2RELA

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