SCHEMBL13358641

SCHEMBL13358641

CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc(/C=C/c5ccc(-c6ccc(N(c7ccc8c(c7)C(C)(C)c7ccccc7-8)c7cccc8ccccc78)cc6)cc5)cc4)cc3)c3cccc4ccccc34)cc21

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.35
MEN1 O00255 2/20 0.35
ALDH1A1 P00352 2/20 0.35
MAPK1 P28482 2/20 0.35
KMT2A Q03164 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
USP2 O75604 1/20 0.35
CTNNB1 P35222 1/20 0.35
ATM Q13315 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
S100A4 P26447 1/20 0.34
PDK2 Q15119 2/20 0.32
APP P05067 3/20 0.30
KDM4E B2RXH2 1/20 0.30
NPC1 O15118 1/20 0.30
LMNA P02545 1/20 0.30
POLB P06746 1/20 0.30
HSP90AA1 P07900 1/20 0.30
THRB P10828 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
SCHEMBL12128437 1.00 MAPT (0.35) MAPTMEN1ALDH1A1MAPK1KMT2A
SCHEMBL13358491 0.97 MEN1 (0.35) MAPTMEN1ALDH1A1MAPK1KMT2A
SCHEMBL13358305 0.97 MEN1 (0.35) MAPTMEN1ALDH1A1MAPK1KMT2A
SCHEMBL13371928 0.97 MEN1 (0.35) MAPTMEN1ALDH1A1MAPK1KMT2A
SCHEMBL13414276 0.97 PDK2 (0.36) MAPTMEN1ALDH1A1MAPK1KMT2A
SCHEMBL13414238 0.96 PDK2 (0.34) MAPTMEN1ALDH1A1MAPK1KMT2A
SCHEMBL12128464 0.95 ALDH1A1 (0.32) MAPTMEN1ALDH1A1MAPK1KMT2A
SCHEMBL13358661 0.93 APP (0.37) MAPTMEN1ALDH1A1MAPK1KMT2A
SCHEMBL13371934 0.93 APP (0.37) MAPTMEN1ALDH1A1MAPK1KMT2A
SCHEMBL13414134 0.93 PDK2 (0.38) MAPTMEN1ALDH1A1MAPK1KMT2A

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