SCHEMBL6803115

SCHEMBL6803115

CC(C)(C)OC(=O)N(CCc1ccc(N)cc1)S(=O)(=O)c1ccccc1F

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 2/20 0.41
PTGER2 P43116 2/20 0.39
ADRB3 P13945 1/20 0.38
KMT2A Q03164 3/20 0.37
MEN1 O00255 2/20 0.37
TDP1 Q9NUW8 2/20 0.36
HSD17B10 Q99714 1/20 0.36
TAS2R14 Q9NYV8 1/20 0.35
HSP90AA1 P07900 1/20 0.35
RCE1 Q9Y256 1/20 0.34
HCRTR2 O43614 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34

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
SCHEMBL6807936 0.85 MMP1 (0.42) KMT2ATDP1
SCHEMBL6798073 0.85 PTPRB (0.44) KCNA5PTGER2KMT2AMEN1
SCHEMBL6807428 0.82 PTGER2 (0.41) PTGER2ADRB3TAS2R14HCRTR2
SCHEMBL7067656 0.80 STAT5B (0.44) ADRB3KMT2AMEN1TAS2R14
SCHEMBL4880111 0.74 CA12 (0.45) KMT2AMEN1RCE1NPSR1
SCHEMBL2595460 0.74 HDAC1 (0.51) RCE1
SCHEMBL27540555 0.74 HDAC1 (0.51) RCE1
SCHEMBL18067949 0.74 ADRB3 (0.46) ADRB3RCE1
SCHEMBL16682328 0.73 ADRB3 (0.44) ADRB3RCE1
SCHEMBL27965195 0.73 STAT5B (0.37) ADRB3

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 KCNA5 4285/4885PTGER2 3225/4885ADRB3 4639/4885

“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.