SCHEMBL6575726

SCHEMBL6575726

CCCS(=O)(=O)NC1CCCC1c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRIA4 P48058 11/20 0.67
GRIA2 P42262 1/20 0.43
ACHE P22303 1/20 0.40
MAPT P10636 2/20 0.38
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37
GAA P10253 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
PSEN1 P49768 1/20 0.37
PSEN2 P49810 1/20 0.37
APH1B Q8WW43 1/20 0.37
NCSTN Q92542 1/20 0.37
APH1A Q96BI3 1/20 0.37
PSENEN Q9NZ42 1/20 0.37

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
SCHEMBL6573755 0.82 GRIA4 (0.48) GRIA4GRIA2PSEN1PSEN2APH1B
SCHEMBL6573066 0.82 GRIA4 (0.62) GRIA4GRIA2PSEN1PSEN2APH1B
SCHEMBL4607627 0.80 GRIA4 (1.00) GRIA4GRIA2ACHE
SCHEMBL6575721 0.80 GRIA4 (1.00) GRIA4GRIA2ACHE
SCHEMBL6761964 0.76 GRIA4 (0.43) GRIA4GRIA2MAPTPSEN1PSEN2
SCHEMBL6574456 0.74 GRIA4 (0.47) GRIA4GRIA2MAPTGAASMN1; SMN2
SCHEMBL6761010 0.74 GRIA4 (0.41) GRIA4GRIA2MAPTPSEN1PSEN2
SCHEMBL4606169 0.70 GRIA4 (0.77) GRIA4GRIA2MAPTMEN1KMT2A
SCHEMBL4606167 0.70 GRIA4 (0.77) GRIA4GRIA2MAPTMEN1KMT2A
SCHEMBL6345768 0.70 MAPT (0.38) GRIA4ACHEMAPTMEN1ALDH1A1

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-20040147612-A1 Sulfonamide derivatives DAVISON JOSHUA ZWICK (US) 2004-07-29 US disclosed
EP-1409452-A1 SULFONAMIDE DERIVATIVES ELI LILLY AND COMPANY (US) 2004-04-21 EP disclosed
WO-2002098846-A1 SULFONAMIDE DERIVATIVES ELI LILLY AND COMPANY (US) 2002-12-12 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-20040147612-A1 Sulfonamide derivatives GRIN1, GRIN2A, GRIA1 GRIA4 9/4885GRIA2 7/4885ACHE 2622/4885

“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.