SCHEMBL2905264

SCHEMBL2905264

CC(CO)(CO)Nc1nc(SCc2cccc(F)c2F)nc2[nH]c(=O)sc12

nearest known ligand 0.71

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 20/20 0.71
CX3CR1 P49238 3/20 0.67
HTR1B P28222 1/20 0.59
CXCR1 P25024 1/20 0.57
CCR7 P32248 1/20 0.52

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
SCHEMBL4693395 0.99 CXCR2 (0.70) CXCR2CX3CR1HTR1BCXCR1CCR7
SCHEMBL4693389 0.99 CXCR2 (0.70) CXCR2CX3CR1HTR1BCXCR1CCR7
SCHEMBL842340 0.93 CXCR2 (0.71) CXCR2CX3CR1HTR1BCXCR1CCR7
SCHEMBL13140053 0.91 CXCR2 (0.70) CXCR2CX3CR1HTR1BCXCR1CCR7
SCHEMBL842296 0.84 CXCR2 (0.72) CXCR2CX3CR1HTR1BCXCR1CCR7
SCHEMBL841899 0.83 CXCR2 (1.00) CXCR2CX3CR1HTR1B
SCHEMBL842524 0.83 CXCR2 (0.86) CXCR2CX3CR1HTR1B
SCHEMBL841616 0.83 CXCR2 (0.98) CXCR2CX3CR1HTR1B
SCHEMBL841617 0.83 CXCR2 (0.98) CXCR2CX3CR1HTR1B
SCHEMBL4711342 0.82 CXCR2 (0.83) 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 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100217000-A1 Process for the Preparation of Thiazolopyrimidines ASTRAZENECA AB (SE) 2010-08-26 US claimed
US-20090043097-A1 Methods ASTRAZENECA AB (SE) 2009-02-12 US claimed
EP-1543013-B1 5-[[(2,3-Difluorophenyl)methyl]thio]-7-[[2-hydroxy-1-(hydroxymethyl)-1-methylethyl]amino]thiazolo[4,5-d]pyrimidin-2(3H)-one monosodium salt as CXCR2 antagonist ASTRAZENECA AB (SE) 2008-12-31 EP claimed
US-20070282103-A1 Process for the Preparation of Thiazolopyrimidines ASTRAZENECA AB (SE) 2007-12-06 US claimed
US-7790883-B2 Process for the preparation of thiazolopyrimidines ASTRAZENECA AB (SE) 2010-09-07 US disclosed
US-7790883-B2 Process for the preparation of thiazolopyrimidines ASTRAZENECA AB (SE) 2010-09-07 US disclosed
US-7790883-B2 Process for the preparation of thiazolopyrimidines ASTRAZENECA AB (SE) 2010-09-07 US disclosed
US-20100217000-A1 Process for the Preparation of Thiazolopyrimidines ASTRAZENECA AB (SE) 2010-08-26 US disclosed
US-20100217000-A1 Process for the Preparation of Thiazolopyrimidines ASTRAZENECA AB (SE) 2010-08-26 US disclosed
US-20100217000-A1 Process for the Preparation of Thiazolopyrimidines ASTRAZENECA AB (SE) 2010-08-26 US disclosed
EP-1711505-B1 PROCESS FOR THE PREPARATION OF THIAZOLOPYRIMIDINES ASTRAZENECA AB (SE) 2010-06-23 EP disclosed
EP-1711505-B1 PROCESS FOR THE PREPARATION OF THIAZOLOPYRIMIDINES ASTRAZENECA AB (SE) 2010-06-23 EP disclosed
EP-1543013-B1 5-[[(2,3-Difluorophenyl)methyl]thio]-7-[[2-hydroxy-1-(hydroxymethyl)-1-methylethyl]amino]thiazolo[4,5-d]pyrimidin-2(3H)-one monosodium salt as CXCR2 antagonist ASTRAZENECA AB (SE) 2008-12-31 EP disclosed
US-20080306262-A1 Novel Compound ASTRAZENECA AB, A SWEDISH CORPORATION 2008-12-11 US disclosed
US-20080306262-A1 Novel Compound ASTRAZENECA AB, A SWEDISH CORPORATION 2008-12-11 US disclosed
US-20080306262-A1 Novel Compound ASTRAZENECA AB, A SWEDISH CORPORATION 2008-12-11 US disclosed
US-20070282103-A1 Process for the Preparation of Thiazolopyrimidines ASTRAZENECA AB (SE) 2007-12-06 US disclosed
US-20070282103-A1 Process for the Preparation of Thiazolopyrimidines ASTRAZENECA AB (SE) 2007-12-06 US disclosed
US-20070282103-A1 Process for the Preparation of Thiazolopyrimidines ASTRAZENECA AB (SE) 2007-12-06 US disclosed
US-20060100221-A1 Novel compound ASTRAZENECA AB (SE) 2006-05-11 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 (5 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-20090043097-A1 Methods CYP21A2, CYP17A1, HSD17B7 CXCR2 2692/4885CX3CR1 4623/4885HTR1B 2485/4885
US-20070282103-A1 Process for the Preparation of Thiazolopyrimidines TPMT, TYMP, DPYD CXCR2 2764/4885CX3CR1 4576/4885HTR1B 2530/4885
US-20060100221-A1 Novel compound SLC10A1, AVPR2, NPC1 CXCR2 156/4885CX3CR1 2854/4885HTR1B 1153/4885
US-20100217000-A1 Process for the Preparation of Thiazolopyrimidines TPMT, TYMP, DPYD CXCR2 2645/4885CX3CR1 4479/4885HTR1B 1867/4885
US-20080306262-A1 Novel Compound SLC10A1, AVPR2, NPC1 CXCR2 156/4885CX3CR1 2854/4885HTR1B 1153/4885

“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.