SCHEMBL13712919

SCHEMBL13712919

Cc1nc2nc(SCc3cccc(F)c3F)nc(NC(C)(CO)CO)c2s1

nearest known ligand 0.81

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CXCR2 P25025 20/20 0.81
▸ CXCR1 P25024 1/20 0.69
▸ CCR7 P32248 1/20 0.56
▸ CX3CR1 P49238 1/20 0.54

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
SCHEMBL4482409 0.90 CXCR2 (0.80) CXCR2CXCR1CCR7CX3CR1
SCHEMBL4475954 0.90 CXCR2 (1.00) CXCR2CXCR1CCR7CX3CR1
SCHEMBL4483211 0.88 CXCR2 (0.77) CXCR2CXCR1CCR7CX3CR1
SCHEMBL841656 0.83 CXCR2 (0.81) CXCR2CXCR1CCR7CX3CR1
SCHEMBL6869113 0.82 CXCR2 (0.80) CXCR2CXCR1CCR7CX3CR1
SCHEMBL842193 0.82 CXCR2 (1.00) CXCR2CXCR1CCR7CX3CR1
SCHEMBL2905264 0.81 CXCR2 (0.71) CXCR2CXCR1CCR7CX3CR1
SCHEMBL842950 0.80 CXCR2 (0.77) CXCR2CXCR1CCR7CX3CR1
SCHEMBL4693395 0.80 CXCR2 (0.70) CXCR2CXCR1CCR7CX3CR1
SCHEMBL6865142 0.80 CXCR2 (0.77) CXCR2CXCR1CCR7CX3CR1

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-7585867-B2 Substituted thiazolo[4,5-d]pyrimidin-2(3H)-one ASTRAZENECA AB (SE) 2009-09-08 — — US disclosed
US-20080306262-A1 Novel Compound ASTRAZENECA AB, A SWEDISH CORPORATION 2008-12-11 — — 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-20080306262-A1 Novel Compound SLC10A1, AVPR2, NPC1 CXCR2 156/4885CXCR1 274/4885CCR7 1417/4885

“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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