SCHEMBL1473557

SCHEMBL1473557

CC(C)(C)c1ccc(OS(=O)(=O)C(F)(F)F)cn1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPRZ1 P23471 1/20 0.38
CXCR2 P25025 2/20 0.38
CA2 P00918 3/20 0.37
CA1 P00915 2/20 0.37
CXCR1 P25024 1/20 0.37
CA9 Q16790 1/20 0.35
HSD11B1 P28845 2/20 0.35
MRGPRX4 Q96LA9 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
LMNA P02545 1/20 0.34
ABCC9 O60706 1/20 0.34
ABCC8 Q09428 1/20 0.34
KCNJ11 Q14654 1/20 0.34
KCNJ8 Q15842 1/20 0.34
ALDH1A1 P00352 1/20 0.34
HTR1A P08908 1/20 0.33
HTR1D P28221 1/20 0.33
HTR1B P28222 1/20 0.33
HTT P42858 1/20 0.33
ELANE P08246 1/20 0.33

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
SCHEMBL752015 0.79 CXCR2 (0.39) CXCR2CA2CA1CXCR1HSD11B1
SCHEMBL6852624 0.79 CA1 (0.40) PTPRZ1CXCR2CA2CA1CXCR1
SCHEMBL7952665 0.77 CA1 (0.39) PTPRZ1CXCR2CA2CA1CXCR1
SCHEMBL24133763 0.77 PDE4A (0.32) ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL22444656 0.77 SLC22A12 (0.43) CXCR2CA2CA1CXCR1LMNA
SCHEMBL22166048 0.75 CXCR2 (0.37) PTPRZ1CXCR2CA2CA1CXCR1
SCHEMBL16854837 0.75 CXCR2 (0.43) CXCR2CA2CA1CXCR1HSD11B1
SCHEMBL20470885 0.75 SCN10A (0.42)
SCHEMBL30536004 0.74 KCNH2 (0.46) PTPRZ1CA2CA1CA9MRGPRX4
SCHEMBL25319233 0.74 KCNH2 (0.46) PTPRZ1CA2CA1CA9MRGPRX4

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-1861359-B1 N-(N-SULFONYLAMINOMETHYL)CYCLOPROPANECARBOXAMIDE DERIVATIVES USEFUL FOR THE TREATMENT OF PAIN PFIZER (US) 2012-11-14 EP disclosed
US-7915448-B2 Substituted sulfonylaminoarylmethyl cyclopropanecarboxamide as VR1 receptor antagonists PFIZER INC. (US) 2011-03-29 US disclosed
US-20100035880-A1 SUBSTITUTED SULFONYLAMINOARYLMETHYL CYCLOPROPANECARBOXAMIDE AS VR1 RECEPTOR ANTAGONISTS PFIZER INC 2010-02-11 US disclosed
US-7622589-B2 Substituted sulfonylaminoarylmethyl cyclopropanecarboxamide as VR1 receptor antagonists PFIZER INC. (US) 2009-11-24 US disclosed
US-20060211741-A1 Substituted sulfonylaminoarylmethyl cyclopropanecarboxamide as VR1 receptor antagonists PFIZER, INC. 2006-09-21 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 (2 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-20060211741-A1 Substituted sulfonylaminoarylmethyl cyclopropanecarboxamide as VR1 receptor antagonists CNR1, HVCN1, CNR2 PTPRZ1 3405/4885CXCR2 416/4885CA2 616/4885
US-20100035880-A1 SUBSTITUTED SULFONYLAMINOARYLMETHYL CYCLOPROPANECARBOXAMIDE AS VR1 RECEPTOR ANTAGONISTS CNR1, HVCN1, CNR2 PTPRZ1 3304/4885CXCR2 422/4885CA2 627/4885

“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.