SCHEMBL19681748

SCHEMBL19681748

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

nearest known ligand 0.69

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 19/20 0.69
CXCR1 P25024 10/20 0.66
CCR7 P32248 1/20 0.66
CCR6 P51684 1/20 0.66

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
SCHEMBL30515695 0.83 CXCR2 (0.74) CXCR2CXCR1CCR7CCR6
SCHEMBL19356188 0.83 CXCR2 (0.74) CXCR2CXCR1CCR7CCR6
SCHEMBL20452298 0.83 CXCR2 (0.74) CXCR2CXCR1CCR7CCR6
SCHEMBL12262972 0.82 CXCR2 (1.00) CXCR2CXCR1CCR7CCR6
SCHEMBL12573315 0.82 CXCR2 (0.85) CXCR2CXCR1CCR7CCR6
SCHEMBL12263221 0.81 CXCR2 (0.70) CXCR2CXCR1CCR7CCR6
SCHEMBL19678009 0.81 CXCR2 (0.70) CXCR2CXCR1CCR7CCR6
SCHEMBL13243271 0.81 CXCR2 (0.83) CXCR2CXCR1CCR7CCR6
SCHEMBL12262978 0.80 CXCR2 (0.70) CXCR2CXCR1CCR7CCR6
Navarixin Anhydrous SCHEMBL184744 0.79 CXCR2 (1.00) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10287278-B2 Chemokine CXCR1 and CXCR2 receptor antagonist compounds, and use thereof in the treatment of chemokine-mediated pathologies GALDERMA RESEARCH & DEVELOPMENT (FR) 2019-05-14 US disclosed
US-20170349575-A1 NOVEL CHEMOKINE CXCR1 AND CXCR2 RECEPTOR ANTAGONIST COMPOUNDS, AND USE THEREOF IN THE TREATMENT OF CHEMOKINE-MEDIATED PATHOLOGIES GALDERMA RESEARCH & DEVELOPMENT (FR) 2017-12-07 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 (2 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-10287278-B2 Chemokine CXCR1 and CXCR2 receptor antagonist compounds, and use thereof in the treatment of chemokine-mediated pathologies CXCR1, CXCR2, CXCR3 CXCR2 2/4885CXCR1 1/4885CCR7 11/4885
US-20170349575-A1 NOVEL CHEMOKINE CXCR1 AND CXCR2 RECEPTOR ANTAGONIST COMPOUNDS, AND USE THEREOF IN THE TREATMENT OF CHEMOKINE-MEDIATED PATHOLOGIES CXCR2, CXCR1, CXCR3 CXCR2 1/4885CXCR1 2/4885CCR7 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.