SCHEMBL6256283

SCHEMBL6256283

C[Si]1(C)C(c2ccc3ccccc3c2)=C(c2ccccc2)C(c2ccccc2)=C1c1ccc2ccccc2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B1 P14061 1/20 0.43
HSD17B2 P37059 1/20 0.43
CYP1A1 P04798 1/20 0.42
CYP1B1 Q16678 1/20 0.42
ESR1 P03372 3/20 0.41
ESR2 Q92731 3/20 0.41
GSTP1 P09211 1/20 0.41
CYP1A2 P05177 4/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
ALDH1A1 P00352 2/20 0.41
HSD17B10 Q99714 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
TP53 P04637 1/20 0.41
KMT2A Q03164 1/20 0.41
CYP17A1 P05093 1/20 0.41
CYP19A1 P11511 1/20 0.41
CYP11B1 P15538 1/20 0.41
CYP11B2 P19099 1/20 0.41
ALOX5 P09917 1/20 0.40

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
SCHEMBL6252563 0.86 CYP1A2 (0.51) HSD17B1HSD17B2GSTP1CYP1A2SMN1; SMN2
SCHEMBL6257971 0.85 CYP2A6 (0.44) HSD17B1HSD17B2ESR1ESR2GSTP1
SCHEMBL6254053 0.85 CYP11B2 (0.54) HSD17B1HSD17B2GSTP1CYP1A2SMN1; SMN2
SCHEMBL6252789 0.84 HSD17B1 (0.40) HSD17B1HSD17B2CYP1A1CYP1B1ESR1
SCHEMBL6252101 0.83 CYP1A1 (0.43) HSD17B1HSD17B2CYP1A1CYP1B1CYP1A2
SCHEMBL6254045 0.83 HSD17B1 (0.39) HSD17B1HSD17B2CYP1A1CYP1B1ESR1
SCHEMBL6252650 0.82 CYP1A1 (0.45) HSD17B1HSD17B2CYP1A1CYP1B1CYP1A2
SCHEMBL6253440 0.82 PRKCZ (0.46) CYP17A1CYP19A1CYP11B1CYP11B2
SCHEMBL6254105 0.82 CYP11B2 (0.44) CYP17A1CYP19A1CYP11B1CYP11B2CYP3A4
SCHEMBL6252623 0.82 CYP1A2 (0.41) HSD17B1HSD17B2CYP1A1CYP1B1ESR1

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070207343-A1 Organic Electroluminescent Device IDEMITSU KOSAN CO., LTD. (JP) 2007-09-06 US disclosed
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