SCHEMBL14436330

SCHEMBL14436330

CN(C)c1ccc(N(c2ccccc2)c2ccc(C=Cc3cc(C#N)c(C=Cc4ccc(N(c5ccccc5)c5ccc(N(C)C)cc5)cc4)cc3C#N)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RELA Q04206 1/20 0.56
APP P05067 8/20 0.50
KDM4E B2RXH2 2/20 0.47
MAPT P10636 4/20 0.43
RAB9A P51151 3/20 0.43
ALDH1A1 P00352 2/20 0.43
MAPK1 P28482 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
SNCA P37840 1/20 0.43
PTGS1 P23219 1/20 0.43
PRKCQ Q04759 1/20 0.42
PRKCD Q05655 1/20 0.42
RAD52 P43351 2/20 0.42
MEN1 O00255 2/20 0.42
NPC1 O15118 2/20 0.42
KMT2A Q03164 2/20 0.42
NSD2 O96028 1/20 0.42
LMNA P02545 1/20 0.42
POLB P06746 1/20 0.42
THRB P10828 1/20 0.42

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
SCHEMBL9915842 0.93 APP (0.46) RELAAPPKDM4EMAPTALDH1A1
SCHEMBL7716038 0.93 APP (0.46) RELAAPPKDM4EMAPTALDH1A1
SCHEMBL14436657 0.89 APP (0.44) RELAAPPKDM4ERAB9AALDH1A1
SCHEMBL14436656 0.89 APP (0.44) RELAAPPKDM4ERAB9AALDH1A1
SCHEMBL14436331 0.86 NFE2L2 (0.43) RELAAPPKDM4EMAPTRAB9A
SCHEMBL830304 0.85 TRPA1 (0.51) RELAKDM4EMAPTALDH1A1LMNA
SCHEMBL18327869 0.85 TRPA1 (0.51) RELAKDM4EMAPTALDH1A1LMNA
SCHEMBL14437326 0.84 APP (0.41) RELAAPPKDM4ERAB9AALDH1A1
SCHEMBL23820710 0.83 APP (0.40) RELAAPPKDM4EMAPTALDH1A1
SCHEMBL22017427 0.82 NFE2L2 (0.41) RELAAPPKDM4ERAB9AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7255935-B2 Organic electroluminescent element and luminescent apparatus employing the same SONY CORPORATION (JP) 2007-08-14 US disclosed