SCHEMBL24755300

SCHEMBL24755300

Cc1ccc(C(Nc2c(Nc3cccc(S(=O)(=O)N(C)C)c3O)c(=O)c2=O)C(C)(C)C)o1

nearest known ligand 0.72

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CCR6 P51684 9/20 0.72
▸ CXCR2 P25025 13/20 0.70
▸ CXCR1 P25024 12/20 0.70
▸ CCR7 P32248 3/20 0.70
▸ CXCR3 P49682 1/20 0.53
▸ CCR4 P51679 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
SCHEMBL13591032 0.92 CXCR2 (0.71) CCR6CXCR2CXCR1CCR7CXCR3
SCHEMBL248399 0.85 CXCR2 (0.69) CCR6CXCR2CXCR1CCR7
SCHEMBL24755302 0.85 CCR6 (0.73) CCR6CXCR2CXCR1CCR7
SCHEMBL20721237 0.84 CCR6 (1.00) CCR6CXCR2CXCR1CXCR3CCR4
SCHEMBL12263728 0.84 CXCR2 (0.61) CCR6CXCR2CXCR1CCR7CXCR3
SCHEMBL13208216 0.83 CXCR1 (0.71) CCR6CXCR2CXCR1CCR7
SCHEMBL13344863 0.83 CXCR1 (0.56) CCR6CXCR2CXCR1CCR7CXCR3
SCHEMBL12262762 0.82 CXCR2 (1.00) CCR6CXCR2CXCR1CCR7CXCR3
SCHEMBL14894868 0.82 CXCR1 (1.00) CCR6CXCR2CXCR1CXCR3CCR4
SCHEMBL14894836 0.82 CXCR1 (1.00) CCR6CXCR2CXCR1CXCR3CCR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220402866-A1 3,4-DISUBSTITUTED 3-CYCLOBUTENE-1,2-DIONES AND USE THEREOF ALLERGAN, INC. 2022-12-22 — — 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-20220402866-A1 3,4-DISUBSTITUTED 3-CYCLOBUTENE-1,2-DIONES AND USE THEREOF IL17A, TSLP, SSB CCR6 197/4885CXCR2 303/4885CXCR1 156/4885

“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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