SCHEMBL9968140

SCHEMBL9968140

CC(C)(C)c1ccc2c(c1)c1nc([Si](C)(C)c3ccc4c(n3)c3cc(C(C)(C)C)ccc3n4-c3ccccc3)ccc1n2-c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.40
KDM4E B2RXH2 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
MAPK1 P28482 2/20 0.40
MEN1 O00255 1/20 0.40
HPGD P15428 1/20 0.40
TSHR P16473 1/20 0.40
CASP1 P29466 1/20 0.40
CASP7 P55210 1/20 0.40
KMT2A Q03164 1/20 0.40
HSD17B10 Q99714 1/20 0.40
ATM Q13315 1/20 0.36
PPARG P37231 6/20 0.34
MAPT P10636 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
DNMT1 P26358 3/20 0.33
MAT2A P31153 1/20 0.33
PGR P06401 1/20 0.33
RORA P35398 1/20 0.33
RORC P51449 1/20 0.33

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
SCHEMBL9968144 0.83 KDM4E (0.38) ALDH1A1KDM4EL3MBTL1MAPK1MEN1
SCHEMBL9968052 0.82 L3MBTL1 (0.52) ALDH1A1KDM4EL3MBTL1MAPK1MEN1
SCHEMBL13146817 0.82 L3MBTL1 (0.52) ALDH1A1KDM4EL3MBTL1MAPK1MEN1
SCHEMBL31621190 0.82 L3MBTL1 (0.52) ALDH1A1KDM4EL3MBTL1MAPK1MEN1
SCHEMBL21515582 0.79 L3MBTL1 (0.48) ALDH1A1KDM4EL3MBTL1MAPK1MEN1
SCHEMBL9968148 0.78 KDM4E (0.38) ALDH1A1KDM4EL3MBTL1MAPK1MEN1
SCHEMBL12354077 0.77 KDM4E (0.62) ALDH1A1KDM4EL3MBTL1MAPK1HPGD
SCHEMBL12104991 0.77 L3MBTL1 (0.47) ALDH1A1KDM4EL3MBTL1MAPK1MEN1
SCHEMBL2604416 0.77 KDM4E (0.47) KDM4EL3MBTL1TSHRATMPPARG
SCHEMBL20100125 0.77 KDM4E (0.47) KDM4EL3MBTL1TSHRATMPPARG

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-20120153817-A1 ORGANIC ELECTROLUMINESCENCE DEVICE FUJIFILM CORPORATION (JP) 2012-06-21 US disclosed
US-20120153817-A1 ORGANIC ELECTROLUMINESCENCE DEVICE FUJIFILM CORPORATION (JP) 2012-06-21 US disclosed