SCHEMBL13358232

SCHEMBL13358232

Cc1ccc(N(c2ccc3c(c2)C(C)(C)c2cc(/C=C/c4ccc(N(c5ccccc5)c5ccccc5)cc4)ccc2-3)c2ccc3c4c(cccc24)-c2ccccc2-3)cc1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.34
APP P05067 1/20 0.34
NFE2L2 Q16236 4/20 0.32
TRPM8 Q7Z2W7 1/20 0.31
MEN1 O00255 1/20 0.30
USP2 O75604 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
MAPK1 P28482 1/20 0.30
CTNNB1 P35222 1/20 0.30
KMT2A Q03164 1/20 0.30
ATM Q13315 1/20 0.30
RXFP1 Q9HBX9 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL13358263 0.95 APP (0.33) PDK2APPMEN1USP2ALDH1A1
SCHEMBL13358587 0.94 PDK2 (0.37) PDK2APPNFE2L2MEN1USP2
SCHEMBL13358572 0.92 MEN1 (0.34) PDK2APPMEN1USP2ALDH1A1
SCHEMBL13358188 0.90 RELA (0.35) PDK2APPMEN1USP2ALDH1A1
SCHEMBL13358694 0.89 PDK2 (0.34) PDK2APP
SCHEMBL13358643 0.89 APP (0.34) PDK2APPMEN1USP2ALDH1A1
SCHEMBL13358273 0.88 APP (0.35) PDK2APPNFE2L2TRPM8MEN1
SCHEMBL13358577 0.88 ALDH1A1 (0.33) PDK2APPMEN1USP2ALDH1A1
SCHEMBL13371897 0.87 PDK2 (0.39) PDK2APPNFE2L2TRPM8ALDH1A1
SCHEMBL13358590 0.87 PDK2 (0.39) PDK2APPNFE2L2TRPM8ALDH1A1

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
WO-2010058995-A1 ELECTROLUMINESCENT DEVICE USING THE ELECTROLUMINESCENT COMPOUNDS GRACEL DISPLAY INC. (KR) 2010-05-27 WO disclosed
EP-2189508-A2 Electroluminescent device using electroluminescent compounds Gracel Display Inc. (KR) 2010-05-26 EP disclosed