SCHEMBL6258564

SCHEMBL6258564

CC[Si]1(CC)C(c2cccc3ncccc23)=C(c2ccccc2)C(c2ccccc2)=C1c1cccc2ncccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.41
ACVR1 Q04771 3/20 0.39
CA12 O43570 2/20 0.39
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
CA9 Q16790 2/20 0.39
ATR Q13535 1/20 0.38
HTR2C P28335 1/20 0.38
TGFBR1 P36897 1/20 0.37
MAPK14 Q16539 1/20 0.37
PGK1 P00558 1/20 0.36
ADORA2A P29274 1/20 0.36
POLB P06746 1/20 0.36
MAPT P10636 2/20 0.36
KDM4E B2RXH2 1/20 0.36
NSD2 O96028 1/20 0.36
ERN1 O75460 1/20 0.36
SLC22A12 Q96S37 1/20 0.36
MCL1 Q07820 1/20 0.35
NPC1 O15118 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
SCHEMBL6256960 0.92 TGFBR1 (0.45) ACVR1HTR2CTGFBR1MAPK14ADORA2A
SCHEMBL6257056 0.88 P2RX7 (0.40) P2RX7ACVR1CA12CA1CA2
SCHEMBL6254424 0.84 P2RX7 (0.41) P2RX7ACVR1CA12CA1CA2
SCHEMBL6257809 0.81 CA12 (0.41) P2RX7ACVR1CA12CA1CA2
SCHEMBL6252141 0.80 ALDH1A1 (0.40) MAPTKDM4EMCL1TP53SMN1; SMN2
SCHEMBL6255877 0.80 TGFBR1 (0.44) ACVR1HTR2CTGFBR1MAPK14MAPT
SCHEMBL6256520 0.80 MAPT (0.41) P2RX7ATRHTR2CMAPTKDM4E
SCHEMBL6258533 0.78 SLC22A12 (0.38) P2RX7ACVR1CA12CA1CA2
SCHEMBL4658401 0.76 CA12 (0.59) P2RX7ACVR1CA12CA1CA2
SCHEMBL6255921 0.75 TGFBR1 (0.45) ACVR1TGFBR1MAPK14MAPTKDM4E

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