SCHEMBL11237924

SCHEMBL11237924

COc1cc(N)c(S(=O)(=O)O)cc1[N+](=O)[O-]

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 2/20 0.45
▸ NSD2 O96028 1/20 0.45
▸ PLCG1 P19174 1/20 0.45
▸ DNMT1 P26358 1/20 0.45
▸ CASP6 P55212 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ HTT P42858 2/20 0.44
▸ TDP1 Q9NUW8 3/20 0.43
▸ PKM P14618 1/20 0.41
▸ ALDH1A1 P00352 7/20 0.40
▸ TUBB4A P04350 1/20 0.40
▸ TUBB P07437 1/20 0.40
▸ TUBA3C P0DPH7 1/20 0.40
▸ TUBA1B P68363 1/20 0.40
▸ TUBA4A P68366 1/20 0.40
▸ TUBB4B P68371 1/20 0.40
▸ TUBB3 Q13509 1/20 0.40
▸ TUBB2A Q13885 1/20 0.40
▸ TUBB8 Q3ZCM7 1/20 0.40
▸ TUBA3E Q6PEY2 1/20 0.40

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
SCHEMBL7521818 0.94 GAA (0.45) GAANSD2PLCG1DNMT1CASP6
SCHEMBL11775501 0.86 HTT (0.45) L3MBTL1HTTTDP1PKMALDH1A1
SCHEMBL11323532 0.86 ALDH1A1 (0.43) L3MBTL1TDP1ALDH1A1TUBB4ATUBB
SCHEMBL11593851 0.84 MAPT (0.47) GAANSD2PLCG1DNMT1CASP6
SCHEMBL11596631 0.84 ALDH1A1 (0.41) GAANSD2PLCG1DNMT1CASP6
SCHEMBL9354657 0.82 PKM (0.49) GAANSD2PLCG1DNMT1CASP6
SCHEMBL343409 0.82 HTT (0.47) GAANSD2PLCG1DNMT1CASP6
SCHEMBL11596939 0.81 MAPT (0.46) GAANSD2PLCG1DNMT1CASP6
SCHEMBL1941394 0.81 HTT (0.46) GAANSD2PLCG1DNMT1CASP6
SCHEMBL10654228 0.80 CASP6 (0.43) GAANSD2PLCG1DNMT1CASP6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4323682-A BLEACHING CATALYSTS CIBA GEIGY AG (CH) 1982-04-06 — — US disclosed
US-4216320-A Quinoxaline bleach catalysts CIBA-GEIGY AG (CH) 1980-08-05 — — US disclosed
US-4202698-A DYE BLEACH CATALYSTS CIBA-GEIGY AG (CH) 1980-05-13 — — US disclosed
US-4145217-A DYE BLEACH CATALYST CIBA-GEIGY AG (CH) 1979-03-20 — — US disclosed
US-4118232-A Photographic material containing sulphonic acid group containing disazo dyestuffs CIBA-GEIGY AG (CH) 1978-10-03 — — US disclosed
US-4051123-A Sulfonic-acid-group containing disazo dyestuffs CIBA-GEIGY AG (CH) 1977-09-27 — — US disclosed
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