SCHEMBL2820262

SCHEMBL2820262

Cc1cc(C)cc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)N2CCC(N3CCCC3)CC2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.52
LMNA P02545 1/20 0.51
ALDH1A1 P00352 7/20 0.48
SMN1; SMN2 Q16637 4/20 0.48
KDM4E B2RXH2 2/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
EBP Q15125 1/20 0.47
DHCR7 Q9UBM7 1/20 0.47
TBXA2R P21731 3/20 0.47
NPSR1 Q6W5P4 2/20 0.46
HPGD P15428 1/20 0.46
MCOLN3 Q8TDD5 1/20 0.46
CYP2C19 P33261 3/20 0.45
CYP1A2 P05177 2/20 0.45
CYP3A4 P08684 2/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2D6 P10635 1/20 0.45
EPHX2 P34913 1/20 0.44
HTT P42858 2/20 0.44

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
SCHEMBL2821983 0.92 L3MBTL1 (0.49) L3MBTL1LMNAALDH1A1SMN1; SMN2KDM4E
SCHEMBL2819926 0.91 TBXA2R (0.50) L3MBTL1LMNAALDH1A1SMN1; SMN2KDM4E
SCHEMBL2821569 0.88 ALDH1A1 (0.52) L3MBTL1LMNAALDH1A1SMN1; SMN2KDM4E
SCHEMBL2820736 0.87 ALDH1A1 (0.54) L3MBTL1LMNAALDH1A1SMN1; SMN2KDM4E
SCHEMBL694001 0.87 L3MBTL1 (0.55) L3MBTL1LMNAALDH1A1SMN1; SMN2KDM4E
SCHEMBL2820423 0.85 LMNA (0.52) L3MBTL1LMNAALDH1A1SMN1; SMN2MEN1
SCHEMBL2820085 0.83 ALDH1A1 (0.56) L3MBTL1LMNAALDH1A1SMN1; SMN2MEN1
SCHEMBL6670476 0.83 ALDH1A1 (0.47) L3MBTL1LMNAALDH1A1SMN1; SMN2KDM4E
SCHEMBL2819710 0.83 ALDH1A1 (0.47) L3MBTL1LMNAALDH1A1SMN1; SMN2KDM4E
SCHEMBL2819893 0.83 L3MBTL1 (0.51) L3MBTL1LMNAALDH1A1SMN1; SMN2MEN1

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 4 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-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 L3MBTL1 4577/4885LMNA 4588/4885ALDH1A1 2416/4885

“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.