SCHEMBL12912901

SCHEMBL12912901

C[Si](C)(c1scc(-c2ccccc2)c1-c1ccccc1)c1scc(-c2ccccc2)c1-c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.40
CYP2A6 P11509 1/20 0.38
CYP2B6 P20813 1/20 0.38
DAPK3 O43293 1/20 0.37
PRKD3 O94806 1/20 0.37
MAP4K4 O95819 1/20 0.37
ABL1 P00519 1/20 0.37
NTRK1 P04629 1/20 0.37
LCK P06239 1/20 0.37
CSF1R P07333 1/20 0.37
RET P07949 1/20 0.37
MET P08581 1/20 0.37
PDGFRB P09619 1/20 0.37
FGFR1 P11362 1/20 0.37
PDGFRA P16234 1/20 0.37
PRKACA P17612 1/20 0.37
FLT1 P17948 1/20 0.37
LTK P29376 1/20 0.37
KDR P35968 1/20 0.37
MAP2K2 P36507 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
SCHEMBL12912947 0.83 PDPK1 (0.34) ALDH1A1CYP2A6CYP2B6DAPK3PRKD3
SCHEMBL12912899 0.79 DAPK3 (0.36) ALDH1A1CYP2A6CYP2B6DAPK3PRKD3
SCHEMBL27836567 0.74 CYP2A6 (0.47) ALDH1A1CYP2A6CYP2B6DAPK3PRKD3
SCHEMBL6036925 0.71 BACE1 (0.41) ALDH1A1CYP2A6CYP2B6DAPK3PRKD3
SCHEMBL12912902 0.71 CYP2A6 (0.43) ALDH1A1CYP2A6CYP2B6DAPK3PRKD3
SCHEMBL2286545 0.69 CYP2A6 (0.38) ALDH1A1CYP2A6CYP2B6DAPK3PRKD3
Phosphine SCHEMBL28718427 0.69 BACE1 (0.41) ALDH1A1CYP2A6CYP2B6DAPK3PRKD3
SCHEMBL8219401 0.69 ALDH1A1 (0.49) ALDH1A1CYP2A6CYP2B6DAPK3PRKD3
SCHEMBL11678420 0.69 CYP2A6 (0.38) ALDH1A1CYP2A6CYP2B6DAPK3PRKD3
SCHEMBL10568574 0.69 PTGS1 (0.49) ALDH1A1CYP2A6CYP2B6DAPK3PRKD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7871714-B2 Polymer, electroluminescent device, and light emitting device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2011-01-18 US disclosed
US-20090102374-A1 POLYMER, ELECTROLUMINESCENT DEVICE, AND LIGHT EMITTING DEVICE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2009-04-23 US disclosed