SCHEMBL11290098

SCHEMBL11290098

Nc1ccc(OS(=O)(=O)O)cc1[N+](=O)[O-]

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.51
MAPT P10636 5/20 0.51
TDP1 Q9NUW8 3/20 0.51
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
POLB P06746 2/20 0.51
CYP3A4 P08684 1/20 0.51
ALOX15 P16050 1/20 0.51
PKM P14618 1/20 0.49
LMNA P02545 2/20 0.49
TSHR P16473 1/20 0.49
GAA P10253 2/20 0.46
HPGD P15428 1/20 0.46
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
NSD2 O96028 1/20 0.44
PLCG1 P19174 1/20 0.44
DNMT1 P26358 1/20 0.44
CASP6 P55212 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44

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
SCHEMBL5036037 0.84 ALDH1A1 (0.47) ALDH1A1MAPTTDP1MEN1KMT2A
SCHEMBL11518080 0.82 FFAR4 (0.56) ALDH1A1MAPTTDP1MEN1KMT2A
SCHEMBL10741844 0.81 ALDH1A1 (0.47) ALDH1A1MAPTTDP1MEN1KMT2A
SCHEMBL11663270 0.81 TDP1 (0.54) ALDH1A1MAPTTDP1MEN1KMT2A
SCHEMBL11628716 0.81 TSHR (0.58) ALDH1A1MAPTTDP1MEN1KMT2A
SCHEMBL5033435 0.81 ALDH1A1 (0.47) ALDH1A1MAPTTDP1MEN1KMT2A
SCHEMBL11627411 0.81 SMN1; SMN2 (0.51) ALDH1A1MAPTTDP1MEN1KMT2A
SCHEMBL7755535 0.81 NSD2 (0.59) ALDH1A1MAPTTDP1MEN1KMT2A
SCHEMBL11627076 0.80 MEN1 (0.46) ALDH1A1MAPTTDP1MEN1KMT2A
SCHEMBL11623279 0.80 SMN1; SMN2 (0.53) ALDH1A1MAPTTDP1MEN1KMT2A

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
EP-0012944-B1 COLOUR-FAST MONOAZO PIGMENT MIXTURES STABLE AGAINST RECRYSTALLISATION, PROCESS FOR THEIR PREPARATION AND THEIR USE HOECHST AKTIENGESELLSCHAFT (DE) 1982-06-23 EP disclosed
EP-0012944-A1 Colour-fast monoazo pigment mixtures stable against recrystallisation, process for their preparation and their use HOECHST AKTIENGESELLSCHAFT (DE) 1980-07-09 EP disclosed