SCHEMBL214542

SCHEMBL214542

CCC[C@H](CO)Nc1nc(S[C@@H](C)c2ccccc2F)nc2[nH]c(=O)sc12

nearest known ligand 0.70

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 20/20 0.70
CX3CR1 P49238 17/20 0.70
HTR1B P28222 1/20 0.47

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
SCHEMBL213072 0.90 CXCR2 (0.80) CXCR2CX3CR1
SCHEMBL212454 0.89 CXCR2 (0.81) CXCR2CX3CR1HTR1B
SCHEMBL214234 0.88 CXCR2 (0.63) CXCR2CX3CR1HTR1B
SCHEMBL214257 0.81 CXCR2 (0.66) CXCR2CX3CR1
SCHEMBL214469 0.81 CXCR2 (0.82) CXCR2CX3CR1
SCHEMBL211982 0.80 CXCR2 (0.64) CXCR2CX3CR1
SCHEMBL213575 0.80 CXCR2 (0.62) CXCR2CX3CR1HTR1B
SCHEMBL12022739 0.80 CXCR2 (0.62) CXCR2CX3CR1HTR1B
SCHEMBL23828012 0.80 CXCR2 (0.77) CXCR2CX3CR1HTR1B
SCHEMBL31199187 0.80 CXCR2 (0.77) 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 3 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 claimed
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.