SCHEMBL2293979

SCHEMBL2293979

CCC(Nc1c(Nc2ccc(Cl)c(S(=O)(=O)N(CC)OC)c2O)c(=O)c1=O)c1ccc(C)o1

nearest known ligand 0.83

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 9/20 0.83
CCR6 P51684 13/20 0.59
CXCR1 P25024 5/20 0.56
CXCR3 P49682 1/20 0.56
CCR4 P51679 1/20 0.56
CCR7 P32248 1/20 0.53

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
SCHEMBL2293975 1.00 CXCR2 (0.83) CXCR2CCR6CXCR1CXCR3CCR4
SCHEMBL1579021 0.91 CXCR2 (1.00) CXCR2CCR6CXCR1CXCR3CCR4
SCHEMBL20452238 0.91 CXCR2 (1.00) CXCR2CCR6CXCR1CXCR3CCR4
SCHEMBL30515707 0.91 CXCR2 (1.00) CXCR2CCR6CXCR1CXCR3CCR4
SCHEMBL2294010 0.86 CCR6 (0.61) CXCR2CCR6
SCHEMBL2293257 0.85 CCR6 (0.78) CXCR2CCR6
SCHEMBL2293252 0.85 CCR6 (0.78) CXCR2CCR6
SCHEMBL15435056 0.85 CCR6 (0.78) CXCR2CCR6
SCHEMBL12262979 0.85 CXCR2 (0.75) CXCR2CCR6CXCR1CXCR3CCR4
SCHEMBL2297899 0.84 CXCR2 (0.62) CXCR2CCR6CXCR1CCR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7989497-B2 Squaramide derivatives as CXCR2 antagonist NOVARTIS AG (CH) 2011-08-02 US claimed
US-9115087-B2 Squaramide derivatives as CXCR2 antagonist NOVARTIS AG (CH) 2015-08-25 US disclosed
US-20140213594-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2014-07-31 US disclosed
US-8722925-B2 Squaramide derivatives as CXCR2 antagonist NOVARTIS AG (CH) 2014-05-13 US disclosed
EP-2310359-B1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2014-01-15 EP disclosed
EP-2310359-B1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2014-01-15 EP disclosed
US-20130005735-A1 ORGANIC COMPOUNDS NOVARTIS AG 2013-01-03 US disclosed
US-8329754-B2 Squaramide derivatives as CXCR2 antagonist NOVARTIS AG (CH) 2012-12-11 US disclosed
US-8288588-B2 Squaramide derivatives as CXCR2 antagonist NOVARTIS AG (CH) 2012-10-16 US disclosed
US-20110251205-A1 SQUARAMIDE DERIVATIVES AS CXCR2 ANTAGONIST NOVARTIS AG 2011-10-13 US disclosed
US-20110251206-A1 Squaramide derivatives as CXCR2 antagonist NOVARTIS AG 2011-10-13 US disclosed
US-7989497-B2 Squaramide derivatives as CXCR2 antagonist NOVARTIS AG (CH) 2011-08-02 US disclosed
US-20100029670-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2010-02-04 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 (5 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-20110251206-A1 Squaramide derivatives as CXCR2 antagonist CXCR2, CXCR3, CXCR1 CXCR2 1/4885CCR6 57/4885CXCR1 3/4885
US-20110251205-A1 SQUARAMIDE DERIVATIVES AS CXCR2 ANTAGONIST CXCR2, CXCR3, CXCR1 CXCR2 1/4885CCR6 57/4885CXCR1 3/4885
US-20100029670-A1 ORGANIC COMPOUNDS CXCR2, CXCR1, CXCR3 CXCR2 1/4885CCR6 30/4885CXCR1 2/4885
US-20130005735-A1 ORGANIC COMPOUNDS CXCR2, CXCR1, CXCR3 CXCR2 1/4885CCR6 30/4885CXCR1 2/4885
US-20140213594-A1 ORGANIC COMPOUNDS CXCR2, CXCR1, CXCR3 CXCR2 1/4885CCR6 30/4885CXCR1 2/4885

“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.