SCHEMBL7218059

SCHEMBL7218059

Cc1ccc(N(c2ccc(C=Cc3ccccc3)cc2)c2c3ccccc3c(-c3c4ccccc4c(N(c4ccc(C)cc4)c4ccc(C=Cc5ccccc5)cc4)c4ccccc34)c3ccccc23)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RELA Q04206 3/20 0.47
CTDSP1 Q9GZU7 1/20 0.41
TRPM8 Q7Z2W7 2/20 0.41
APP P05067 1/20 0.41
KDM4E B2RXH2 2/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
CASP3 P42574 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40
NFE2L2 Q16236 4/20 0.39
PTGS2 P35354 1/20 0.39
HPGD P15428 3/20 0.37
CYP1B1 Q16678 1/20 0.37
ALDH1A1 P00352 1/20 0.37
CYP3A4 P08684 1/20 0.37
MAPT P10636 1/20 0.37
FGF23 Q9GZV9 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.36

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
SCHEMBL14537294 0.97 RELA (0.42) RELACTDSP1TRPM8APPKDM4E
SCHEMBL14537298 0.97 RELA (0.42) RELACTDSP1TRPM8APPKDM4E
SCHEMBL14537281 0.92 RELA (0.46) RELACTDSP1TRPM8APPKDM4E
SCHEMBL7218838 0.90 RELA (0.48) RELACTDSP1TRPM8APPKDM4E
SCHEMBL14537279 0.90 APP (0.44) RELACTDSP1TRPM8APPKDM4E
SCHEMBL14537299 0.89 RELA (0.39) RELACTDSP1TRPM8APPKDM4E
SCHEMBL14537275 0.89 RELA (0.49) RELACTDSP1TRPM8APPKDM4E
SCHEMBL13807870 0.88 APP (0.43) RELACTDSP1TRPM8APPKDM4E
SCHEMBL7218845 0.87 CYP2C19 (0.40) TRPM8APPKDM4EHPGDALDH1A1
SCHEMBL2540242 0.87 ALDH1A1 (0.39) KDM4ENFE2L2HPGDALDH1A1CYP3A4

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-6582837-B1 Device having one or more organic thin layers including luminescent layer between anode and cathode, wherein at least one layer contains selected compound or compounds; exhibits higher-luminance luminescence than conventional device NEC CORPORATION (JP) 2003-06-24 US disclosed