SCHEMBL11519196

SCHEMBL11519196

O=[N+]([O-])c1ccccc1-c1ccc(/N=N/c2ccc(O)cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.59
ALDH1A1 P00352 2/20 0.59
KMT2A Q03164 8/20 0.47
MEN1 O00255 7/20 0.47
NPC1 O15118 3/20 0.47
GPR35 Q9HC97 1/20 0.46
MAPT P10636 5/20 0.45
MAPK1 P28482 2/20 0.45
GAA P10253 1/20 0.45
PKM P14618 1/20 0.45
RAB9A P51151 2/20 0.44
CRHBP P24387 1/20 0.42
CRHR2 Q13324 1/20 0.42
ADAMTS4 O75173 1/20 0.42
LMNA P02545 1/20 0.42
POLB P06746 1/20 0.42
HTT P42858 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
THRB P10828 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
SCHEMBL3555427 0.90 ALDH1A1 (0.71) TDP1ALDH1A1KMT2AMEN1GPR35
SCHEMBL11217415 0.81 IDE (0.53) TDP1ALDH1A1KMT2AMEN1NPC1
SCHEMBL17695176 0.80 ALDH1A1 (0.67) TDP1ALDH1A1KMT2AMEN1GPR35
SCHEMBL1124773 0.76 ALDH1A1 (0.61) TDP1ALDH1A1KMT2AGPR35GAA
SCHEMBL2958562 0.76 ALDH1A1 (0.92) TDP1ALDH1A1KMT2AMEN1MAPK1
SCHEMBL44392 0.75 ALDH1A1 (1.00) TDP1ALDH1A1KMT2AMEN1MAPK1
Benzene SCHEMBL28038982 0.75 ALDH1A1 (1.00) TDP1ALDH1A1KMT2AMEN1MAPK1
SCHEMBL30196067 0.75 ALDH1A1 (1.00) TDP1ALDH1A1KMT2AMEN1MAPK1
SCHEMBL28674811 0.75 ALDH1A1 (0.59) TDP1ALDH1A1KMT2ANPC1GPR35
SCHEMBL21082742 0.75 MEN1 (0.56) TDP1ALDH1A1KMT2AMEN1NPC1

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-4134888-A LIQUID CRYSTALS RCA CORPORATION (US) 1979-01-16 US disclosed
US-4032470-A LIQUID CRYSTAL MONOAZO DYES RCA CORPORATION (US) 1977-06-28 US disclosed