SCHEMBL2019574

SCHEMBL2019574

CCC[C@H](CO)NC1=CN(SSc2nc(N[C@@H](CO)CCC)c3sc(OC)nc3n2)Cc2sc(OC)nc21

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 19/20 0.41
CX3CR1 P49238 14/20 0.41
ADORA1 P30542 1/20 0.31

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
SCHEMBL12022728 0.81 CXCR2 (0.52) CXCR2CX3CR1ADORA1
SCHEMBL213688 0.81 CXCR2 (0.52) CXCR2CX3CR1ADORA1
SCHEMBL213689 0.81 CXCR2 (0.52) CXCR2CX3CR1ADORA1
SCHEMBL2019579 0.75 CXCR2 (0.39) CXCR2CX3CR1
SCHEMBL5436823 0.71 CXCR2 (0.76) CXCR2CX3CR1
SCHEMBL213960 0.69 CX3CR1 (0.54) CXCR2CX3CR1ADORA1
SCHEMBL12022709 0.69 CX3CR1 (0.54) CXCR2CX3CR1ADORA1
SCHEMBL211982 0.68 CXCR2 (0.64) CXCR2CX3CR1ADORA1
SCHEMBL12022742 0.67 CXCR2 (0.53) CXCR2CX3CR1ADORA1
SCHEMBL215490 0.67 CXCR2 (0.53) CXCR2CX3CR1ADORA1

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-7960395-B2 5,7-disubstituted thiazolo[4,5-d]pyrimidines for the selective inhibition of chemokine receptors ASTRAZENECA AB (SE) 2011-06-14 US disclosed
US-20080318981-A1 Novel Compounds 480 ASTRAZENECA AB (SE) 2008-12-25 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-20080318981-A1 Novel Compounds 480 CX3CR1, CCR2, CXCR3 CXCR2 6/4885CX3CR1 1/4885ADORA1 188/4885

“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.