SCHEMBL13826488

SCHEMBL13826488

CC(C)(C)c1ccc(/N=C2\CCCc3ccccc32)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.46
HPGD P15428 1/20 0.46
ALDH1A1 P00352 7/20 0.42
G6PC1 P35575 1/20 0.41
MAPT P10636 4/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
PLA2G1B P04054 1/20 0.39
ATG4B Q9Y4P1 1/20 0.39
LMNA P02545 3/20 0.39
RAB9A P51151 3/20 0.39
NPSR1 Q6W5P4 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
KDM4E B2RXH2 1/20 0.39
HTT P42858 1/20 0.39
GAA P10253 3/20 0.39
ALOX12 P18054 1/20 0.39
CYP2A6 P11509 1/20 0.39
MAOA P21397 1/20 0.39

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
SCHEMBL19733319 0.82 L3MBTL1 (0.56) L3MBTL1HPGDALDH1A1G6PC1MAPT
SCHEMBL19713080 0.82 L3MBTL1 (0.56) L3MBTL1HPGDALDH1A1G6PC1MAPT
SCHEMBL19433073 0.82 L3MBTL1 (0.56) L3MBTL1HPGDALDH1A1G6PC1MAPT
SCHEMBL31285577 0.79 ALDH1A1 (0.59) L3MBTL1HPGDALDH1A1G6PC1MAPT
SCHEMBL15323580 0.79 ALDH1A1 (0.59) L3MBTL1HPGDALDH1A1G6PC1MAPT
SCHEMBL16566630 0.79 ALDH1A1 (0.59) L3MBTL1HPGDALDH1A1G6PC1MAPT
SCHEMBL16566632 0.79 ALDH1A1 (0.59) L3MBTL1HPGDALDH1A1G6PC1MAPT
SCHEMBL15324625 0.78 ALDH1A1 (0.57) L3MBTL1HPGDALDH1A1G6PC1MAPT
SCHEMBL15324626 0.78 ALDH1A1 (0.57) L3MBTL1HPGDALDH1A1G6PC1MAPT
SCHEMBL24105655 0.76 ALDH1A1 (0.55) L3MBTL1HPGDALDH1A1MAPTMEN1

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-20140217376-A1 ORGANIC LIGHT EMISSIVE MATERIAL AND DEVICE SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2014-08-07 US disclosed
WO-2012153082-A1 ORGANIC LIGHT EMISSIVE MATERIAL AND DEVICE CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2012-11-15 WO disclosed