SCHEMBL9602589

SCHEMBL9602589

O=[N+]([O-])c1c(O)cnc2ccccc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S100A4 P26447 2/20 0.53
ERN1 O75460 1/20 0.51
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
ALDH1A1 P00352 3/20 0.44
POLB P06746 2/20 0.44
CTSB P07858 2/20 0.43
NPC1 O15118 3/20 0.43
ABCG2 Q9UNQ0 1/20 0.43
DUSP3 P51452 1/20 0.43
PTPN5 P54829 1/20 0.43
PTPN11 Q06124 1/20 0.43
CYP3A4 P08684 1/20 0.42
KDM4E B2RXH2 4/20 0.41
LMNA P02545 3/20 0.41
MAPT P10636 3/20 0.41
HTT P42858 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
RAB9A P51151 2/20 0.41
GPR35 Q9HC97 1/20 0.41

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
SCHEMBL8561101 0.81 POLB (0.53) S100A4MEN1KMT2AALDH1A1POLB
SCHEMBL8568380 0.79 MEN1 (0.45) S100A4MEN1KMT2AALDH1A1POLB
SCHEMBL202480 0.79 MEN1 (0.45) S100A4MEN1KMT2AALDH1A1POLB
SCHEMBL31581131 0.79 MEN1 (0.45) S100A4MEN1KMT2AALDH1A1POLB
SCHEMBL3037149 0.78 POLB (0.54) S100A4ERN1MEN1KMT2AALDH1A1
SCHEMBL8566835 0.77 MEN1 (0.43) S100A4ERN1MEN1KMT2AALDH1A1
SCHEMBL1033969 0.76 POLB (0.51) S100A4ERN1MEN1KMT2AALDH1A1
SCHEMBL28579892 0.74 S100A4 (0.50) S100A4MEN1KMT2AALDH1A1POLB
SCHEMBL20291524 0.74 CYP3A4 (0.61) S100A4MEN1KMT2AALDH1A1POLB
SCHEMBL9621885 0.73 S100A4 (0.83) S100A4MEN1KMT2AALDH1A1POLB

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0310950-B1 Quinoline intermediates for the synthesis of 1H-imidazo[4,5-c]quinolines and 1H-imidazo[4,5-c]quinolin-4-amimes RIKER LABORATORIES, INC. (US) 1993-01-13 EP disclosed
EP-0145340-B1 1H-Imidazo[4,5-c]quinolines and 1H-imidazo[4,5-c]quinolin-4-amines RIKER LABORATORIES, INC. (US) 1990-01-24 EP disclosed
EP-0310950-A1 Quinoline intermediates for the synthesis of 1H-imidazo[4,5-c]quinolines and 1H-imidazo[4,5-c]quinolin-4-amimes RIKER LABORATORIES, INC. (US) 1989-04-12 EP disclosed
EP-0145340-A2 1H-Imidazo[4,5-c]quinolines and 1H-imidazo[4,5-c]quinolin-4-amines RIKER LABORATORIES, INC. (US) 1985-06-19 EP disclosed