SCHEMBL213575

SCHEMBL213575

CCC[C@H](CO)Nc1nc(SSc2nc(N[C@@H](CO)CCC)c3sc(=O)[nH]c3n2)nc2[nH]c(=O)sc12

nearest known ligand 0.62

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 19/20 0.62
CX3CR1 P49238 15/20 0.62
HTR1B P28222 1/20 0.44
TLR8 Q9NR97 1/20 0.34

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
SCHEMBL12022739 1.00 CXCR2 (0.62) CXCR2CX3CR1HTR1BTLR8
SCHEMBL212299 0.86 CXCR2 (0.71) CXCR2CX3CR1HTR1B
SCHEMBL12022718 0.86 CXCR2 (0.71) CXCR2CX3CR1HTR1B
SCHEMBL5438905 0.83 CXCR2 (0.85) CXCR2CX3CR1HTR1B
SCHEMBL212454 0.83 CXCR2 (0.81) CXCR2CX3CR1HTR1B
SCHEMBL214542 0.80 CXCR2 (0.70) CXCR2CX3CR1HTR1B
SCHEMBL1860231 0.78 CXCR2 (0.70) CXCR2CX3CR1HTR1B
SCHEMBL211990 0.76 CXCR2 (1.00) CXCR2CX3CR1HTR1B
SCHEMBL212918 0.76 CXCR2 (0.75) CXCR2CX3CR1HTR1B
SCHEMBL2003466 0.75 CXCR2 (0.72) CXCR2CX3CR1HTR1B

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-8088780-B2 5,7-disubstituted thiazolo[4,5-D]pyrimidines for the selective inhibition of chemokine receptors ASTRAZENECA AB (SE) 2012-01-03 US disclosed
US-20090124637-A1 Novel 5,7-Disubstituted [1,3]Thiazolo[4,5-D]Pyrimidin-2(3H)-One Derivatives 794 ASTRAZENECA AB (SE) 2009-05-14 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-20090124637-A1 Novel 5,7-Disubstituted [1,3]Thiazolo[4,5-D]Pyrimidin-2(3H)-One Derivatives 794 CX3CR1, CCR2, CCR5 CXCR2 5/4885CX3CR1 1/4885HTR1B 907/4885

“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.