SCHEMBL6741834

SCHEMBL6741834

O=NN(c1ccccc1)c1ccc(NS(=O)(=O)c2ccccc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.61
MEN1 O00255 4/20 0.61
ALDH1A1 P00352 3/20 0.61
PKM P14618 2/20 0.61
KEAP1 Q14145 2/20 0.59
IL1RN P18510 1/20 0.59
ERAP1 Q9NZ08 1/20 0.59
HPGD P15428 2/20 0.57
MAPT P10636 1/20 0.57
ALOX15 P16050 1/20 0.55
CA12 O43570 2/20 0.54
CA1 P00915 2/20 0.54
CA2 P00918 2/20 0.54
CA9 Q16790 2/20 0.54
PGR P06401 1/20 0.53
NR1I2 O75469 1/20 0.49
HTR6 P50406 1/20 0.49
LMNA P02545 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.49

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
SCHEMBL6738009 0.86 KEAP1 (0.53) KMT2AMEN1ALDH1A1PKMKEAP1
SCHEMBL810795 0.80 KMT2A (0.91) KMT2AMEN1ALDH1A1PKMKEAP1
SCHEMBL9480255 0.80 NR3C2 (0.70) KMT2AMEN1ALDH1A1PKMKEAP1
SCHEMBL6741160 0.79 ALDH1A1 (0.67) KMT2AMEN1ALDH1A1PKMKEAP1
SCHEMBL5718766 0.78 ALDH1A1 (0.73) KMT2AMEN1ALDH1A1PKMKEAP1
SCHEMBL9001182 0.77 KMT2A (1.00) KMT2AMEN1ALDH1A1PKMKEAP1
SCHEMBL25031372 0.76 KEAP1 (1.00) KMT2AMEN1ALDH1A1PKMKEAP1
Phenyl(Phenylsulfonyl)Amine SCHEMBL114765 0.76 KEAP1 (1.00) KMT2AMEN1ALDH1A1PKMKEAP1
SCHEMBL9292268 0.76 ALDH1A1 (0.94) KMT2AMEN1ALDH1A1PKMHPGD
SCHEMBL13167612 0.75 KMT2A (0.80) KMT2AMEN1ALDH1A1PKMKEAP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040063783-A1 Nitroso diphenylamine derivatives MERCK PATENT GMBH (DE) 2004-04-01 US disclosed
EP-1322598-A1 NITROSO DIPHENYLAMINE DERIVATIVES MERCK PATENT GmbH (DE) 2003-07-02 EP disclosed
WO-2002028820-A1 NITROSO DIPHENYLAMINE DERIVATIVES MERCK PATENT GMBH (DE) 2002-04-11 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040063783-A1 Nitroso diphenylamine derivatives NQO2, SULT1A1, NAT1 KMT2A 531/4885MEN1 3077/4885ALDH1A1 167/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.