SCHEMBL6804358

SCHEMBL6804358

CS(=O)(=O)NCCc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.62
CA2 P00918 3/20 0.62
CA12 O43570 1/20 0.55
CA4 P22748 1/20 0.55
TSHR P16473 1/20 0.51
KCNH2 Q12809 2/20 0.51
KCNJ1 P48048 1/20 0.51
CYP19A1 P11511 1/20 0.50
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
MAPT P10636 3/20 0.48
POLB P06746 1/20 0.47
KDM4E B2RXH2 1/20 0.47
USP2 O75604 1/20 0.47
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.47
RAB9A P51151 1/20 0.47

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
SCHEMBL28821113 0.83 CA1 (0.62) CA1CA2CA12CA4TSHR
SCHEMBL2027835 0.83 CA2 (0.60) CA1CA2CA12CA4KCNH2
SCHEMBL3188711 0.81 POLB (0.58) TSHRCYP19A1MEN1KMT2AMAPT
SCHEMBL6801249 0.80 ALDH1A1 (0.77) CA1CA2MEN1KMT2AMAPT
SCHEMBL991622 0.79 TSHR (0.58) CA1CA2CA12CA4TSHR
SCHEMBL4818387 0.79 MAPT (0.75) CA1CA2MEN1KMT2AMAPT
SCHEMBL6804800 0.78 MAPT (0.58) CA1CA2CA12CA4KCNH2
SCHEMBL10494724 0.78 MAPT (0.58) CA1CA2CA12CA4KCNH2
SCHEMBL6803445 0.78 CA1 (0.77) CA1CA2CYP19A1MEN1KMT2A
SCHEMBL5991959 0.78 GRIA4 (0.63) CA1CA2CA12MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 CA1 2299/4885CA2 1472/4885CA12 2951/4885

“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.