SCHEMBL2297899

SCHEMBL2297899

CC[C@@H](Nc1c(Nc2cccc(S(=O)(=O)N(CC)OC)c2O)c(=O)c1=O)c1ccc(C)o1

nearest known ligand 0.62

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 19/20 0.62
CXCR1 P25024 10/20 0.61
CCR7 P32248 1/20 0.61
CCR6 P51684 1/20 0.61

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
SCHEMBL12087050 0.89 CXCR2 (0.66) CXCR2CXCR1CCR7CCR6
SCHEMBL248399 0.88 CXCR2 (0.69) CXCR2CXCR1CCR7CCR6
SCHEMBL2298023 0.85 CXCR2 (0.59) CXCR2CXCR1CCR6
SCHEMBL19678009 0.85 CXCR2 (0.70) CXCR2CXCR1CCR7CCR6
SCHEMBL2293975 0.84 CXCR2 (0.83) CXCR2CXCR1CCR7CCR6
SCHEMBL2293979 0.84 CXCR2 (0.83) CXCR2CXCR1CCR7CCR6
SCHEMBL12262978 0.84 CXCR2 (0.70) CXCR2CXCR1CCR7CCR6
SCHEMBL19678010 0.82 CXCR2 (0.66) CXCR2CXCR1CCR7CCR6
SCHEMBL12263782 0.82 CXCR2 (0.68) CXCR2CXCR1CCR7CCR6
SCHEMBL12087138 0.80 CXCR2 (0.62) CXCR2CXCR1CCR7CCR6

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 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9115087-B2 Squaramide derivatives as CXCR2 antagonist NOVARTIS AG (CH) 2015-08-25 US disclosed
US-9115087-B2 Squaramide derivatives as CXCR2 antagonist NOVARTIS AG (CH) 2015-08-25 US disclosed
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-20140213594-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2014-07-31 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
US-8722925-B2 Squaramide derivatives as CXCR2 antagonist NOVARTIS AG (CH) 2014-05-13 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
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-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-7989497-B2 Squaramide derivatives as CXCR2 antagonist NOVARTIS AG (CH) 2011-08-02 US disclosed
US-7989497-B2 Squaramide derivatives as CXCR2 antagonist NOVARTIS AG (CH) 2011-08-02 US disclosed
WO-2010015613-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2010-02-11 WO disclosed
US-20100029670-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2010-02-04 US disclosed
US-20100029670-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2010-02-04 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 (4 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 1/4885CXCR1 3/4885CCR7 17/4885
US-20110251205-A1 SQUARAMIDE DERIVATIVES AS CXCR2 ANTAGONIST CXCR2, CXCR3, CXCR1 CXCR2 1/4885CXCR1 3/4885CCR7 17/4885
US-20100029670-A1 ORGANIC COMPOUNDS CXCR2, CXCR1, CXCR3 CXCR2 1/4885CXCR1 2/4885CCR7 23/4885
US-20140213594-A1 ORGANIC COMPOUNDS CXCR2, CXCR1, CXCR3 CXCR2 1/4885CXCR1 2/4885CCR7 23/4885

“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.