SCHEMBL14569482

SCHEMBL14569482

CN(C)c1ccc(N(c2ccccc2)c2ccc(C=Cc3ccc4c(C#N)c5cc(C=Cc6ccc(N(c7ccccc7)c7ccc(N(C)C)cc7)cc6)ccc5c(C#N)c4c3)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RELA Q04206 1/20 0.51
KDM4E B2RXH2 2/20 0.48
APP P05067 7/20 0.43
MAPT P10636 5/20 0.41
RAB9A P51151 4/20 0.41
ALDH1A1 P00352 3/20 0.41
MAPK1 P28482 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
ERBB2 P04626 1/20 0.41
NQO2 P16083 1/20 0.40
PTGS1 P23219 1/20 0.40
MEN1 O00255 3/20 0.39
NPC1 O15118 3/20 0.39
KMT2A Q03164 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
HTT P42858 2/20 0.39
ALOX15 P16050 1/20 0.39
CASP1 P29466 1/20 0.39
HBB P68871 1/20 0.39
LMNA P02545 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
SCHEMBL14569512 0.93 APP (0.40) RELAKDM4EAPPMAPTALDH1A1
SCHEMBL14569509 0.90 APP (0.39) RELAKDM4EAPPMAPTRAB9A
SCHEMBL10074381 0.88 APP (0.41) RELAKDM4EAPPMAPTRAB9A
SCHEMBL14079459 0.88 APP (0.38) RELAKDM4EAPPALDH1A1L3MBTL1
SCHEMBL14558900 0.88 RELA (0.44) RELAKDM4EAPPMAPTRAB9A
SCHEMBL14569529 0.87 APP (0.40) RELAKDM4EAPPMAPTRAB9A
SCHEMBL12310026 0.87 APP (0.38) RELAKDM4EAPPMAPTRAB9A
SCHEMBL14569792 0.86 TRPA1 (0.48) RELAKDM4EAPPMAPTALDH1A1
SCHEMBL14079455 0.86 APP (0.41) RELAKDM4EAPPMAPTRAB9A
SCHEMBL10074384 0.86 APP (0.38) RELAKDM4EAPPMAPTALDH1A1

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-7196225-B2 Bis(aminostyryl) anthracene compound, synthesis intermediate thereof, and process for production thereof SONY CORPORATION (JP) 2007-03-27 US disclosed