SCHEMBL6804800

SCHEMBL6804800

O=[N+]([O-])c1ccc(CCNS(=O)(=O)Cc2ccccc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.58
GAA P10253 2/20 0.58
MEN1 O00255 3/20 0.57
KMT2A Q03164 3/20 0.57
CA1 P00915 2/20 0.57
CA2 P00918 2/20 0.57
HTT P42858 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
NPC1 O15118 1/20 0.55
RAB9A P51151 1/20 0.55
TAAR1 Q96RJ0 1/20 0.55
ALDH1A1 P00352 2/20 0.51
LMNA P02545 1/20 0.51
MAOA P21397 1/20 0.51
MAOB P27338 1/20 0.51
CA12 O43570 1/20 0.50
CA4 P22748 1/20 0.50
POLB P06746 1/20 0.49
KCNH2 Q12809 1/20 0.49
CYP1A2 P05177 2/20 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
SCHEMBL10494724 1.00 MAPT (0.58) MAPTGAAMEN1KMT2ACA1
SCHEMBL1938386 0.86 HPGD (0.55) MAPTMEN1KMT2ASMN1; SMN2NPC1
SCHEMBL10494697 0.85 MAPT (0.60) MAPTGAAMEN1KMT2ACA1
SCHEMBL4601440 0.84 CA1 (0.59) MAPTGAAMEN1KMT2ACA1
SCHEMBL6803445 0.82 CA1 (0.77) MAPTGAAMEN1KMT2ACA1
SCHEMBL4692690 0.81 MAPT (0.56) MAPTGAAMEN1KMT2ACA1
SCHEMBL28487383 0.81 MEN1 (0.75) MAPTMEN1KMT2ACA1CA2
SCHEMBL2999740 0.80 MAPT (0.57) MAPTGAAMEN1KMT2ACA1
Hydrochloric Acid SCHEMBL28638069 0.80 MEN1 (0.73) MAPTGAAMEN1KMT2ACA1
SCHEMBL29866201 0.79 MAPT (0.48) MAPTGAAMEN1KMT2ACA1

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
WO-2004074238-A1 PHENETHYLAMINO SULFAMIC ACIDS THE PROCTER & GAMBLE COMPANY (US) 2004-09-02 WO disclosed
US-20040167183-A1 Phenethylamino sulfamic acids THE PROCTER & GAMBLE COMPANY 2004-08-26 US 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-20040167183-A1 Phenethylamino sulfamic acids PTPRM, PTPRS, PTPRE MAPT 3227/4885GAA 152/4885MEN1 4379/4885

“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.