SCHEMBL8091855

SCHEMBL8091855

O=c1c2ccccc2n(-c2ccccc2)c2ccc([N+](=O)[O-])cc12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.55
MEN1 O00255 5/20 0.54
KMT2A Q03164 5/20 0.54
ALDH1A1 P00352 5/20 0.54
MPI P34949 1/20 0.54
APOBEC3G Q9HC16 1/20 0.54
LMNA P02545 3/20 0.51
P2RX4 Q99571 1/20 0.51
CTSV O60911 1/20 0.50
CTSL P07711 1/20 0.50
POLB P06746 2/20 0.49
ATM Q13315 2/20 0.49
G6PD P11413 1/20 0.49
TLR9 Q9NR96 1/20 0.49
PDE4A P27815 1/20 0.48
PDE4B Q07343 1/20 0.48
PDE4C Q08493 1/20 0.48
PDE4D Q08499 1/20 0.48
L3MBTL1 Q9Y468 2/20 0.47
KDM4E B2RXH2 1/20 0.47

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
SCHEMBL18109210 0.90 MAPT (0.68) MAPTMEN1KMT2AALDH1A1MPI
SCHEMBL31548612 0.90 MAPT (0.68) MAPTMEN1KMT2AALDH1A1MPI
SCHEMBL18109229 0.88 MEN1 (0.62) MAPTMEN1KMT2AALDH1A1MPI
SCHEMBL8739924 0.86 MAPT (0.62) MAPTMEN1KMT2AALDH1A1MPI
SCHEMBL22282320 0.82 MAPT (0.80) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL29519306 0.82 MAPT (0.80) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL8739884 0.82 MAPT (0.66) MAPTMEN1KMT2AALDH1A1MPI
SCHEMBL28097826 0.82 MAPT (0.61) MAPTMEN1KMT2AALDH1A1MPI
SCHEMBL29127703 0.80 KMT2A (0.54) MAPTMEN1KMT2AALDH1A1MPI
SCHEMBL29416587 0.80 KDM4E (0.63) MEN1KMT2AALDH1A1P2RX4POLB

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-6054501-A CURABILITY; GLOSSINESS; CAN BE BLENDED WITH INKS, PAINTS NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2000-04-25 US disclosed
EP-0844255-A1 PHOTOPOLYMERIZATION INITIATOR AND ACTINIC RADIATION-CURABLE COMPOSITION COMPRISING THE SAME NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1998-05-27 EP disclosed