SCHEMBL10758207

SCHEMBL10758207

COc1ccc([N+](=O)[O-])c(C=C2NC(=O)NC2=O)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.66
NCOA1 Q15788 1/20 0.66
NCOA3 Q9Y6Q9 1/20 0.66
GSK3B P49841 3/20 0.55
CLK1 P49759 1/20 0.55
DYRK1A Q13627 1/20 0.55
MEN1 O00255 5/20 0.49
KMT2A Q03164 5/20 0.49
MAPT P10636 8/20 0.47
ALDH1A1 P00352 5/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
XDH P47989 1/20 0.46
GAA P10253 2/20 0.45
LMNA P02545 2/20 0.45
RECQL P46063 2/20 0.45
MCL1 Q07820 1/20 0.45
KDM4E B2RXH2 3/20 0.44
BACE1 P56817 1/20 0.44
METAP1 P53582 1/20 0.43
HPGD P15428 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
SCHEMBL10758203 1.00 POLB (0.66) POLBNCOA1NCOA3GSK3BCLK1
SCHEMBL10757983 0.86 MAPT (0.56) POLBNCOA1NCOA3GSK3BCLK1
SCHEMBL10757993 0.86 MAPT (0.56) POLBNCOA1NCOA3GSK3BCLK1
SCHEMBL10656339 0.82 MAPT (0.49) POLBNCOA1NCOA3MEN1KMT2A
SCHEMBL10656336 0.82 MAPT (0.49) POLBNCOA1NCOA3MEN1KMT2A
SCHEMBL10657374 0.81 MAPT (0.46) POLBNCOA1NCOA3MEN1KMT2A
SCHEMBL10657357 0.81 MAPT (0.46) POLBNCOA1NCOA3MEN1KMT2A
SCHEMBL10657362 0.81 MAPT (0.46) POLBNCOA1NCOA3MEN1KMT2A
SCHEMBL10656043 0.81 POLB (0.44) POLBNCOA1NCOA3GSK3BCLK1
SCHEMBL10656355 0.80 MAPT (0.48) POLBNCOA1NCOA3MEN1KMT2A

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-4668686-A 1,3-DIHYDRO-2H-IMIDAZO/4,5-B/QUINOLINE-2-ONES BRISTOL-MYERS COMPANY (US) 1987-05-26 US disclosed