SCHEMBL1706227

SCHEMBL1706227

CN(C)C(=O)c1cccc(Nc2c(NC3CCOC3)c(=O)c2=O)c1O

nearest known ligand 0.88

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CXCR2 P25025 13/20 0.88
▸ CCR6 P51684 7/20 0.63
▸ CXCR1 P25024 5/20 0.60
▸ CCR7 P32248 1/20 0.56

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
SCHEMBL1706225 1.00 CXCR2 (0.88) CXCR2CCR6CXCR1CCR7
SCHEMBL1707013 1.00 CXCR2 (0.88) CXCR2CCR6CXCR1CCR7
SCHEMBL12086719 0.94 CXCR2 (1.00) CXCR2CCR6CXCR1CCR7
SCHEMBL12262520 0.89 CXCR2 (0.93) CXCR2CCR6CXCR1
SCHEMBL12087214 0.85 CXCR2 (0.95) CXCR2CCR6CXCR1
SCHEMBL12087261 0.85 CXCR2 (1.00) CXCR2CCR6CXCR1
SCHEMBL12086733 0.84 CXCR2 (1.00) CXCR2CCR6CXCR1
SCHEMBL12087229 0.84 CXCR2 (1.00) CXCR2CCR6CXCR1
SCHEMBL12262452 0.84 CXCR2 (0.85) CXCR2CCR6CXCR1CCR7
SCHEMBL1706371 0.81 CXCR2 (0.74) 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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8183281-B2 CXC-chemokine receptor ligands NOVARTIS AG (CH) 2012-05-22 — — US claimed
EP-2155670-B1 ANTI -INFLAMMATORY SUBSTITUTED CYCLOBUTENEDIONE COMPOUNDS NOVARTIS AG (CH) 2012-04-18 — — EP claimed
US-20100125071-A1 CXC-CHEMOKINE RECEPTOR LIGANDS NOVARTIS AG (CH) 2010-05-20 — — US claimed
EP-2155670-A1 ANTI -INFLAMMATORY SUBSTITUTED CYCLOBUTENEDIONE COMPOUNDS Novartis Ag (CH) 2010-02-24 — — EP claimed
WO-2008148790-A1 ANTI -INFLAMMATORY SUBSTITUTED CYCLOBUTENEDIONE COMPOUNDS NOVARTIS AG (CH) 2008-12-11 — — WO claimed
US-8183281-B2 CXC-chemokine receptor ligands NOVARTIS AG (CH) 2012-05-22 — — US disclosed
EP-2155670-B1 ANTI -INFLAMMATORY SUBSTITUTED CYCLOBUTENEDIONE COMPOUNDS NOVARTIS AG (CH) 2012-04-18 — — EP disclosed
US-20100125071-A1 CXC-CHEMOKINE RECEPTOR LIGANDS NOVARTIS AG (CH) 2010-05-20 — — 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 (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-20100125071-A1 CXC-CHEMOKINE RECEPTOR LIGANDS CXCR2, CXCR1, CX3CR1 CXCR2 1/4885CCR6 20/4885CXCR1 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.

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