SCHEMBL3008577

SCHEMBL3008577

Cc1cc(F)c(S(=O)(=O)N2CCN(C(=O)O)CC2)cc1[N+](=O)[O-]

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
SMN1; SMN2 Q16637 2/20 0.47
LMNA P02545 1/20 0.47
POLB P06746 1/20 0.47
ALDH1A1 P00352 5/20 0.45
MAPT P10636 1/20 0.45
PKM P14618 3/20 0.44
GAA P10253 1/20 0.44
MCOLN3 Q8TDD5 2/20 0.43
CRHBP P24387 1/20 0.43
CRHR2 Q13324 1/20 0.43

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
SCHEMBL3008572 1.00 MEN1 (0.49) MEN1KMT2AL3MBTL1SMN1; SMN2LMNA
SCHEMBL2820255 0.85 MEN1 (0.53) MEN1KMT2AL3MBTL1SMN1; SMN2LMNA
SCHEMBL6648839 0.79 KMT2A (0.46) MEN1KMT2AL3MBTL1SMN1; SMN2LMNA
SCHEMBL6648841 0.79 KMT2A (0.46) MEN1KMT2AL3MBTL1SMN1; SMN2LMNA
SCHEMBL18230449 0.77 KMT2A (0.69) MEN1KMT2ALMNAPOLBALDH1A1
SCHEMBL18230447 0.77 KMT2A (0.69) MEN1KMT2ALMNAPOLBALDH1A1
SCHEMBL29451625 0.74 ALDH1A1 (0.49) KMT2AL3MBTL1SMN1; SMN2LMNAALDH1A1
SCHEMBL8512706 0.72 TNF (0.54) SMN1; SMN2LMNAPOLBALDH1A1MAPT
SCHEMBL29451375 0.72 ALDH1A1 (0.53) MEN1KMT2AL3MBTL1SMN1; SMN2LMNA
SCHEMBL11964594 0.70 VCAM1 (0.41) MEN1KMT2ASMN1; SMN2ALDH1A1MAPT

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
US-8242118-B2 Arylsulfonamide derivatives for use as CCR3 antagonists in the treatment of inflammatory and immunological disorders AXIKIN PHARMACEUTICALS INC. (US) 2012-08-14 US disclosed
US-20100204213-A1 ARYLSULFONAMIDE DERIVATIVES FOR USE AS CCR3 ANTAGONISTS IN THE TREATMENT OF INFLAMMATORY AND IMMUNOLOGICAL DISORDERS BAYER HEALTHCARE AG (DE) 2010-08-12 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-20100204213-A1 ARYLSULFONAMIDE DERIVATIVES FOR USE AS CCR3 ANTAGONISTS IN THE TREATMENT OF INFLAMMATORY AND IMMUNOLOGICAL DISORDERS CCR3, CCR1, CCR2 MEN1 4873/4885KMT2A 2753/4885L3MBTL1 4577/4885

“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.