SCHEMBL6799665

SCHEMBL6799665

CC(C)(C)C(CN(C(=O)O)S(=O)(=O)c1cccc(F)c1)c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 5/20 0.40
MMP2 P08253 5/20 0.40
MMP9 P14780 5/20 0.40
MMP8 P22894 5/20 0.40
MMP13 P45452 5/20 0.40
MAPT P10636 1/20 0.38
MAPK1 P28482 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PTGER2 P43116 2/20 0.38

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
SCHEMBL6800871 0.86 ALDH1A1 (0.37) MMP1MMP2MMP9MMP8MMP13
SCHEMBL6807429 0.86 PTGER2 (0.40) MMP1MMP2MMP9MMP13PTGER2
SCHEMBL6807939 0.84 KMT2A (0.40)
SCHEMBL6799662 0.72 MMP1 (0.47) MMP1MMP2MMP9MMP8MMP13
SCHEMBL28783481 0.67 CA12 (0.57) MMP1MMP2MMP9MMP8MMP13
SCHEMBL531217 0.65 GBA1 (0.57) MAPT
SCHEMBL14974818 0.65 GBA1 (0.57) MAPT
SCHEMBL14974819 0.65 GBA1 (0.57) MAPT
SCHEMBL16468409 0.65 CYP1A2 (0.53) MAPTMAPK1SMN1; SMN2
Hydrochloric Acid SCHEMBL15757862 0.65 GBA1 (0.56) MAPT

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 MMP1 857/4885MMP2 630/4885MMP9 2969/4885

“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.