SCHEMBL2820982

SCHEMBL2820982

O=[N+]([O-])c1ccc(Oc2ccccc2)c(S(=O)(=O)N2CCNCC2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.49
ALDH1A1 P00352 7/20 0.47
SMN1; SMN2 Q16637 5/20 0.47
MEN1 O00255 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
LMNA P02545 3/20 0.46
CYP3A4 P08684 3/20 0.46
CYP2C9 P11712 3/20 0.46
HPGD P15428 2/20 0.46
CYP1A2 P05177 2/20 0.46
NPSR1 Q6W5P4 2/20 0.46
KDM4E B2RXH2 2/20 0.46
TSHR P16473 2/20 0.46
MLNR O43193 1/20 0.46
MMP1 P03956 1/20 0.46
MPO P05164 1/20 0.46
GLA P06280 1/20 0.46
ADORA3 P0DMS8 1/20 0.46
MAPT P10636 1/20 0.46
CYP19A1 P11511 1/20 0.46

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
SCHEMBL2820559 0.92 KMT2A (0.48) KMT2AALDH1A1SMN1; SMN2MEN1L3MBTL1
SCHEMBL2822115 0.92 HTR1A (0.46) KMT2AALDH1A1SMN1; SMN2MEN1L3MBTL1
SCHEMBL2819558 0.89 ALDH1A1 (0.57) KMT2AALDH1A1SMN1; SMN2MEN1L3MBTL1
SCHEMBL2821327 0.89 HSPB1 (0.53) KMT2AALDH1A1SMN1; SMN2MEN1L3MBTL1
SCHEMBL2822351 0.89 PDE7A (0.55) KMT2AALDH1A1SMN1; SMN2MEN1L3MBTL1
SCHEMBL2823186 0.89 KMT2A (0.62) KMT2AALDH1A1SMN1; SMN2MEN1L3MBTL1
SCHEMBL2818841 0.89 KMT2A (0.53) KMT2AALDH1A1SMN1; SMN2MEN1L3MBTL1
SCHEMBL3112601 0.88 TBXA2R (0.54) KMT2AALDH1A1SMN1; SMN2MEN1L3MBTL1
SCHEMBL2819885 0.88 TBXA2R (0.55) KMT2AALDH1A1SMN1; SMN2MEN1L3MBTL1
SCHEMBL2821007 0.88 ALDH1A1 (0.49) KMT2AALDH1A1SMN1; SMN2MEN1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1849469-B1 Arylsulfonamide derivatives for use as CCR3 antagonists in the treatment of inflammatory and immunological disorders AXIKIN PHARMACEUTICALS INC (US) 2010-10-27 EP claimed
US-7700586-B2 Arylsulfonamide derivatives for use as ccr3 antagonists in the treatment of inflammatory and immunological disorders AXIKIN PHARMACEUTICALS, INC. (US) 2010-04-20 US claimed
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
US-7700586-B2 Arylsulfonamide derivatives for use as ccr3 antagonists in the treatment of inflammatory and immunological disorders AXIKIN PHARMACEUTICALS, INC. (US) 2010-04-20 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 KMT2A 2753/4885ALDH1A1 2416/4885SMN1; SMN2 2924/4885

“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.