SCHEMBL6256255

SCHEMBL6256255

CC[Si]1(CC)C(c2ccc3cccnc3c2)=C(c2ccccc2)C(c2ccccc2)=C1c1ccc2cccnc2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.43
NR4A2 P43354 1/20 0.43
NPC1 O15118 2/20 0.42
CYP3A4 P08684 2/20 0.42
MEN1 O00255 1/20 0.40
CASP1 P29466 1/20 0.40
CASP7 P55210 1/20 0.40
KMT2A Q03164 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C19 P33261 1/20 0.40
HTT P42858 1/20 0.40
GSK3B P49841 1/20 0.38
CYP2D6 P10635 1/20 0.38
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38
SLC6A3 Q01959 1/20 0.38
POLB P06746 1/20 0.38
RAB9A P51151 1/20 0.38
MET P08581 1/20 0.37
PDE10A Q9Y233 1/20 0.37

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
SCHEMBL6259242 0.89 NPC1 (0.53) ALDH1A1NPC1CYP3A4CASP1CYP1A2
SCHEMBL6257057 0.88 ALDH1A1 (0.42) ALDH1A1NR4A2NPC1CYP3A4MEN1
SCHEMBL6253762 0.84 ALDH1A1 (0.43) ALDH1A1NR4A2NPC1CYP3A4MEN1
SCHEMBL6254919 0.81 HSD17B1 (0.40) ALDH1A1MEN1KMT2ACYP1A2ADORA2A
SCHEMBL6256942 0.81 NR4A2 (0.45) ALDH1A1NR4A2NPC1CYP3A4MEN1
SCHEMBL6252862 0.78 ALDH1A1 (0.40) ALDH1A1NR4A2NPC1CYP3A4MEN1
SCHEMBL6255482 0.77 NPC1 (0.51) ALDH1A1NPC1CYP3A4CASP1CYP1A2
SCHEMBL6005419 0.76 NPC1 (0.59) ALDH1A1NR4A2NPC1CYP3A4MEN1
SCHEMBL12075052 0.76 NPC1 (0.59) ALDH1A1NR4A2NPC1CYP3A4MEN1
SCHEMBL6256075 0.75 CYP2A6 (0.47) CYP1A2RAB9A

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