SCHEMBL14453379

SCHEMBL14453379

Cc1ccc(CNc2c(Nc3cccc(C(=O)N(C)C)c3O)c(=O)c2=O)o1

nearest known ligand 0.73

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 20/20 0.73
CXCR1 P25024 14/20 0.66
CCR7 P32248 4/20 0.65
CCR6 P51684 1/20 0.65

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
SCHEMBL20865603 0.90 CXCR2 (0.73) CXCR2CXCR1CCR7CCR6
SCHEMBL1682706 0.88 CXCR2 (0.64) CXCR2CXCR1CCR7CCR6
SCHEMBL247336 0.84 CXCR2 (0.74) CXCR2CXCR1CCR6
SCHEMBL247335 0.84 CXCR2 (1.00) CXCR2CXCR1CCR6
SCHEMBL18870051 0.82 CXCR2 (0.66) CXCR2CXCR1CCR7CCR6
SCHEMBL12262726 0.82 CXCR2 (0.68) CXCR2CXCR1CCR6
SCHEMBL13076091 0.82 CXCR2 (0.66) CXCR2CXCR1CCR7CCR6
SCHEMBL12262212 0.81 CXCR2 (1.00) CXCR2CXCR1CCR6
SCHEMBL14319674 0.81 CXCR2 (0.64) CXCR2CXCR1CCR7CCR6
SCHEMBL14450094 0.81 CXCR2 (0.78) CXCR2CXCR1CCR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2019067332-A1 COMPOSITIONS AND METHODS FOR TREATING CANCER WITH A COMBINATION OF PROGRAMMED DEATH RECEPTOR (PD-1) ANTIBODIES AND A CXCR2 ANTAGONIST MERCK SHARP & DOHME CORP. (US) 2019-04-04 WO disclosed
EP-2178826-B1 PROCESS AND INTERMEDIATES FOR THE SYNTHESIS OF 1,2-SUBSTITUTED 3,4-DIOXO-1-CYCLOBUTENE COMPOUNDS MERCK SHARP & DOHME (US) 2017-05-17 EP disclosed
EP-2168956-B1 Synthesis of 2-Hydroxy-N,N-Dimethyl-3-[[2-[1(r) - (5-Methyl-2-Furanyl) Propyl] -3, 4-Dioxo-1-Cyclobuten-1-Yl]amino] Benzamide MERCK SHARP & DOHME (US) 2013-03-20 EP disclosed
US-20070155756-A1 Treatment of chemokine mediated diseases SCHERING CORPORATION 2007-07-05 US disclosed
US-20070155756-A1 Treatment of chemokine mediated diseases SCHERING CORPORATION 2007-07-05 US disclosed
EP-1381590-B1 3,4-DI-SUBSTITUTED CYCLOBUTENE-1,2-DIONES AS CXC-CHEMOKINE RECEPTOR LIGANDS SCHERING CORP (US) 2007-06-20 EP 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-20070155756-A1 Treatment of chemokine mediated diseases CXCR3, ACKR3, CCL11 CXCR2 6/4885CXCR1 5/4885CCR7 14/4885

“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.