SCHEMBL14516005

SCHEMBL14516005

C[Si](C)(C)c1ccc(N(c2ccc([Si](C)(C)C)cc2)c2ccc3c(-c4cccc5ccccc45)c4cc(N(c5ccc([Si](C)(C)C)cc5)c5ccc([Si](C)(C)C)cc5)ccc4c(-c4cccc5ccccc45)c3c2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHFR P00374 1/20 0.37
PSD A5PKW4 1/20 0.34
ALOX15 P16050 1/20 0.33
KDM4E B2RXH2 3/20 0.33
ENPP3 O14638 1/20 0.33
ENPP1 P22413 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
NISCH Q9Y2I1 1/20 0.33
KCNQ3 O43525 2/20 0.32
KCNQ2 O43526 2/20 0.32
SOS1 Q07889 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TP53 P04637 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
NFKB1 P19838 1/20 0.32
MAPK1 P28482 1/20 0.32
NFKB2 Q00653 1/20 0.32

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
SCHEMBL761416 0.97 DHFR (0.35) DHFRPSDALOX15KDM4EENPP3
SCHEMBL762139 0.94 ALDH1A1 (0.36) DHFRKDM4EENPP3ENPP1MEN1
SCHEMBL760844 0.92 DHFR (0.34) DHFRPSDALOX15KDM4EENPP3
SCHEMBL14516006 0.92 KCNQ3 (0.35) DHFRPSDKCNQ3KCNQ2ALDH1A1
SCHEMBL760843 0.88 ENPP1 (0.39) KDM4EENPP3ENPP1ALDH1A1TP53
SCHEMBL14424846 0.87 KDM1A (0.33) KDM4EENPP3ENPP1MEN1KMT2A
SCHEMBL761302 0.87 ENPP1 (0.38) KDM4EENPP3ENPP1ALDH1A1TP53
SCHEMBL12014672 0.86 SOS1 (0.39) DHFRPSDKDM4EMEN1KMT2A
SCHEMBL8406123 0.86 SOS1 (0.39) DHFRPSDKDM4EMEN1KMT2A
SCHEMBL14099720 0.85 DHFR (0.39) DHFRKDM4ESOS1ALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8647753-B2 Organic electroluminescence device LG DISPLAY CO., LTD. (KR) 2014-02-11 US disclosed
US-8647753-B2 Organic electroluminescence device LG DISPLAY CO., LTD. (KR) 2014-02-11 US disclosed
US-20070087222-A1 Organic electroluminescence device LG DISPLAY CO., LTD. (KR) 2007-04-19 US disclosed