SCHEMBL2819926

SCHEMBL2819926

Cc1cc(C)cc(Oc2ccc([N+](=O)[O-])cc2S(=O)(=O)N2CCN(C3CCCCC3)CC2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TBXA2R P21731 3/20 0.50
L3MBTL1 Q9Y468 1/20 0.48
LMNA P02545 1/20 0.47
KDM4E B2RXH2 5/20 0.47
GAA P10253 1/20 0.47
ALDH1A1 P00352 8/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
EPHX2 P34913 1/20 0.46
CYP1A2 P05177 2/20 0.45
CYP3A4 P08684 2/20 0.45
CYP2C19 P33261 2/20 0.45
HTT P42858 2/20 0.45
NPSR1 Q6W5P4 2/20 0.45
HPGD P15428 1/20 0.45
MCOLN3 Q8TDD5 1/20 0.45
NPC1 O15118 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
CYP2C9 P11712 1/20 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 0.99 L3MBTL1 (0.49) TBXA2RL3MBTL1LMNAKDM4EGAA
SCHEMBL2820262 0.91 L3MBTL1 (0.52) TBXA2RL3MBTL1LMNAKDM4EALDH1A1
SCHEMBL693089 0.87 L3MBTL1 (0.52) TBXA2RL3MBTL1LMNAKDM4EGAA
SCHEMBL2820085 0.85 ALDH1A1 (0.56) TBXA2RL3MBTL1LMNAGAAALDH1A1
SCHEMBL15704481 0.82 L3MBTL1 (0.71) L3MBTL1LMNAKDM4EGAAALDH1A1
SCHEMBL2820423 0.82 LMNA (0.52) TBXA2RL3MBTL1LMNAALDH1A1SMN1; SMN2
SCHEMBL2824042 0.82 L3MBTL1 (0.49) TBXA2RL3MBTL1LMNAGAAALDH1A1
SCHEMBL693142 0.82 L3MBTL1 (0.49) TBXA2RL3MBTL1LMNAGAAALDH1A1
SCHEMBL2818837 0.82 MAPT (0.54) TBXA2RL3MBTL1LMNAALDH1A1SMN1; SMN2
SCHEMBL694213 0.82 ALDH1A1 (0.53) L3MBTL1LMNAKDM4EGAAALDH1A1

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 TBXA2R 1120/4885L3MBTL1 4577/4885LMNA 4588/4885

“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.