SCHEMBL2767447

SCHEMBL2767447

Nc1ccc(Cl)c(S(=O)(=O)N2CCNCC2)c1O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 4/20 0.54
MAPT P10636 2/20 0.49
USP2 O75604 1/20 0.49
PKLR P30613 1/20 0.41
ALDH1A1 P00352 2/20 0.40
MAPK1 P28482 2/20 0.40
MEN1 O00255 1/20 0.40
TP53 P04637 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
NFKB1 P19838 1/20 0.40
KMT2A Q03164 1/20 0.40
MYLK Q15746 1/20 0.40
GMNN O75496 1/20 0.39
LMNA P02545 1/20 0.39
PMP22 Q01453 1/20 0.39
TDO2 P48775 1/20 0.39
PKM P14618 1/20 0.38

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
SCHEMBL2770715 0.95 CXCR2 (0.50) CXCR2MAPTUSP2PKLRALDH1A1
SCHEMBL6564215 0.87 CXCR2 (0.44) CXCR2LMNACNR1CCR6
SCHEMBL6562315 0.86 CXCR2 (0.45) CXCR2ALDH1A1MEN1KMT2ACNR1
SCHEMBL13205457 0.86 ALDH1A1 (0.45) CXCR2USP2ALDH1A1MEN1KMT2A
SCHEMBL17293683 0.85 TSHR (0.46) CXCR2USP2ALDH1A1MEN1CYP3A4
SCHEMBL1563469 0.82 CXCR2 (0.54) CXCR2MEN1KMT2ACCR6
SCHEMBL6562108 0.82 CCR6 (0.41) CXCR2CNR1CCR6
SCHEMBL6563361 0.82 POLB (0.44) MAPTUSP2MAPK1MEN1KMT2A
SCHEMBL6562111 0.82 CCR6 (0.41) CXCR2CYP3A4KMT2ACNR1CCR6
SCHEMBL17293877 0.81 ATM (0.43) CXCR2ALDH1A1MAPK1MEN1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100256157-A1 METHOD OF TREATMENT GLAXOSMITHKLINE LLC 2010-10-07 US disclosed
EP-1272175-B1 N,N'-DIARYL GUANIDINES AS IL-8 RECEPTOR ANTAGONISTS GLAXOSMITHKLINE LLC (US) 2010-04-21 EP disclosed
US-20090281110-A1 Method of Treatment SMITHKLINE BEECHAM CORPORATION 2009-11-12 US disclosed
US-20090170871-A1 IL-8 Receptor Antagonists SMITHKLINE BEECHAM CORPORATION (US) 2009-07-02 US disclosed
EP-1351933-B1 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2006-11-22 EP disclosed
US-20060084641-A1 IL-8 receptor antagonists SMITHKLINE BEECHAM CORPORATION 2006-04-20 US disclosed
EP-1351933-A4 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2005-09-07 EP disclosed
EP-1272175-A4 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2005-08-31 EP disclosed
US-20040048897-A1 Il-8 receptor antagonists SMITHKLINE BEECHAM CORPORATION 2004-03-11 US disclosed
US-6680317-B2 N-(PHENYL)-N*-(2-HYDROXY-3-AMINOSULFONYLPHENYL)GUANIDINE DERIVATIVES; CHEMOKINE INHIBITORS; RESPIRATORY, CARDIOVASCULAR, RHEUMATIC, BRAIN, AND NERVOUS SYSTEM DISORDERS SMITHKLINE BEECHAM CORPORATION 2004-01-20 US disclosed
US-20030216375-A1 Il-8 receptor anatagonists GLAXOSMITHKLINE LLC 2003-11-20 US disclosed
CN-1452483-A IL-8 receptor antagonists SMITHKLINE BEECHAM CORP (US) 2003-10-29 CN disclosed
EP-1351933-A1 IL-8 RECEPTOR ANTAGONISTS SmithKline Beecham Corporation (US) 2003-10-15 EP disclosed
EP-1272175-A2 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2003-01-08 EP disclosed
WO-2002057230-A1 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2002-07-25 WO disclosed
WO-2001072960-A2 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2001-10-04 WO 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 (6 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-20100256157-A1 METHOD OF TREATMENT CFTR, CTH, TST CXCR2 794/4885MAPT 4780/4885USP2 42/4885
US-20030216375-A1 Il-8 receptor anatagonists CXCL8, CCR8, IL1R1 CXCR2 28/4885MAPT 2200/4885USP2 4521/4885
US-20040048897-A1 Il-8 receptor antagonists CXCL8, CCR8, TLR8 CXCR2 11/4885MAPT 3239/4885USP2 3113/4885
US-20090281110-A1 Method of Treatment ESR2, CTH, SULT2A1 CXCR2 2176/4885MAPT 3380/4885USP2 60/4885
US-20060084641-A1 IL-8 receptor antagonists CXCL8, CCR8, TLR8 CXCR2 11/4885MAPT 3239/4885USP2 3113/4885
US-20090170871-A1 IL-8 Receptor Antagonists CXCL8, CCR8, IL1RN CXCR2 12/4885MAPT 2222/4885USP2 3921/4885

“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.