SCHEMBL10068047

SCHEMBL10068047

N#Cc1ccc(/C=C/c2ccc3cc(/C=C/c4ccc5cc(/C=C/c6ccc(C#N)cc6)ccc5c4)ccc3c2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RELA Q04206 1/20 0.52
FBP1 P09467 1/20 0.48
ALDH1A1 P00352 4/20 0.43
MAPT P10636 2/20 0.43
LMNA P02545 2/20 0.43
HDAC2 Q92769 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
P4HB P07237 4/20 0.43
GLA P06280 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
PTGS1 P23219 1/20 0.41
KDM4E B2RXH2 1/20 0.41
GAA P10253 1/20 0.41
MAOB P27338 1/20 0.41
NR1H3 Q13133 1/20 0.41
PLG P00747 1/20 0.40
PLAU P00749 1/20 0.40
PLAT P00750 1/20 0.40
KLK1 P06870 1/20 0.40
CYP2A6 P11509 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
SCHEMBL11491866 0.92 RELA (0.66) RELAFBP1ALDH1A1MAPTLMNA
SCHEMBL12300202 0.90 FBP1 (0.44) RELAFBP1ALDH1A1MAPTLMNA
SCHEMBL13267897 0.88 HRH3 (0.49) RELAFBP1HDAC2
SCHEMBL12300538 0.88 FBP1 (0.43) RELAFBP1ALDH1A1MAPTLMNA
SCHEMBL7338887 0.87 RELA (0.63) RELAFBP1ALDH1A1MAPTLMNA
SCHEMBL7338903 0.87 RELA (0.63) RELAFBP1ALDH1A1MAPTLMNA
SCHEMBL1260529 0.86 FBP1 (0.59) FBP1ALDH1A1MAPTLMNAHDAC2
SCHEMBL1687898 0.86 FBP1 (0.59) FBP1ALDH1A1MAPTLMNAHDAC2
SCHEMBL21574805 0.86 FBP1 (0.59) FBP1ALDH1A1MAPTLMNAHDAC2
SCHEMBL8699093 0.86 FBP1 (0.59) FBP1ALDH1A1MAPTLMNAHDAC2

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
US-8148720-B2 Organic thin film transistor and organic thin film light-emitting transistor IDEMITSU KOSAN CO., LTD. (JP) 2012-04-03 US disclosed
US-20100051918-A1 ORGANIC THIN FILM TRANSISTOR AND ORGANIC THIN FILM LIGHT-EMITTING TRANSISTOR IDEMITSU KOSAN CO., LTD. (JP) 2010-03-04 US disclosed