SCHEMBL841652

SCHEMBL841652

Nc1nc2nc(SCc3cccc(F)c3F)nc(Cl)c2s1

nearest known ligand 0.65

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 19/20 0.65
PAK4 O96013 1/20 0.63
CXCR1 P25024 1/20 0.63
CX3CR1 P49238 2/20 0.59

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
SCHEMBL843318 0.87 CXCR2 (0.50) CXCR2PAK4CXCR1CX3CR1
SCHEMBL13980260 0.84 CXCR2 (0.66) CXCR2CXCR1CX3CR1
SCHEMBL842213 0.83 CXCR2 (0.48) CXCR2PAK4CXCR1CX3CR1
SCHEMBL6859607 0.81 CXCR2 (0.72) CXCR2PAK4CXCR1CX3CR1
SCHEMBL215475 0.81 PAK4 (0.60) CXCR2PAK4CXCR1CX3CR1
SCHEMBL6865488 0.81 CXCR2 (0.69) CXCR2PAK4CXCR1CX3CR1
SCHEMBL5035710 0.80 CXCR2 (0.74) CXCR2PAK4CXCR1CX3CR1
SCHEMBL6865964 0.79 CXCR2 (0.67) CXCR2PAK4CXCR1CX3CR1
SCHEMBL4488684 0.79 CXCR2 (1.00) CXCR2CXCR1CX3CR1
SCHEMBL841694 0.78 CXCR2 (0.84) CXCR2CXCR1CX3CR1

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 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8143261-B2 Thiazolo (4,5-D) pyrimidine compounds ASTRAZENECA AB (SE) 2012-03-27 US disclosed
US-20090281123-A1 NOVEL THIAZOLO (4,5-D) PYRIMIDINE COMPOUNDS NOVEL COMPOUNDS ASTRAZENECA UK LIMITED 2009-11-12 US disclosed
US-7585867-B2 Substituted thiazolo[4,5-d]pyrimidin-2(3H)-one ASTRAZENECA AB (SE) 2009-09-08 US disclosed
US-7585867-B2 Substituted thiazolo[4,5-d]pyrimidin-2(3H)-one ASTRAZENECA AB (SE) 2009-09-08 US disclosed
US-7585867-B2 Substituted thiazolo[4,5-d]pyrimidin-2(3H)-one ASTRAZENECA AB (SE) 2009-09-08 US 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
EP-1542974-B1 5-[((2,3-difluorophenyl)methyl)thio]-7-{[(1S,2S)-2-hydroxy-1-(hydroxymethyl)propyl]amino}thiazolo[4,5-d]pyrimidin-2(3H)-one as CXCR2 antagonist ASTRAZENECA AB (SE) 2008-12-31 EP disclosed
EP-1542974-B1 5-[((2,3-difluorophenyl)methyl)thio]-7-{[(1S,2S)-2-hydroxy-1-(hydroxymethyl)propyl]amino}thiazolo[4,5-d]pyrimidin-2(3H)-one 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-20060100221-A1 Novel compound ASTRAZENECA AB (SE) 2006-05-11 US disclosed
US-20050272750-A1 Novel compound ASTRAZENECA AB (SE) 2005-12-08 US disclosed
US-6949643-B2 Thiazolopytimidines and their use as modulators of chemokine receptor activity ASTRAZENECA AB (SE) 2005-09-27 US disclosed
EP-1385854-B1 THIAZOLOPYRIMIDINES AND THEIR USE AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY ASTRAZENECA AB (SE) 2005-02-09 EP disclosed
US-20040224961-A1 Novel thiazolo (4,5-D) pyrimidine compounds ASTRAZENECA UK LIMITED, A BRITISH CORPORATION 2004-11-11 US disclosed
US-6790850-B1 Thiazolo(4,5-d)pyrimidine compounds ASTRAZENECA UK LIMITED (GB) 2004-09-14 US disclosed
US-20040157853-A1 Thiazolopytimidines and their use as modulators of chemokine receptor activity ASTRAZENECA AB (SE) 2004-08-12 US disclosed
US-20040106628-A1 Novel use ASTRAZENECA AB (SE) 2004-06-03 US disclosed
EP-1222195-B1 NOVEL THIAZOLO(4,5-D)PYRIMIDINE COMPOUNDS ASTRAZENECA UK LTD (GB) 2004-01-14 EP disclosed
EP-1348709-A2 Thiazolo (4,5-D) pyrimidine compounds AstraZeneca UK Limited (GB) 2003-10-01 EP 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 (7 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-20040157853-A1 Thiazolopytimidines and their use as modulators of chemokine receptor activity CCR5, CCR2, CX3CR1 CXCR2 5/4885PAK4 1061/4885CXCR1 4/4885
US-20040224961-A1 Novel thiazolo (4,5-D) pyrimidine compounds TYMS, DPYD, TYMP CXCR2 378/4885PAK4 624/4885CXCR1 318/4885
US-20060100221-A1 Novel compound SLC10A1, AVPR2, NPC1 CXCR2 156/4885PAK4 1890/4885CXCR1 274/4885
US-20090281123-A1 NOVEL THIAZOLO (4,5-D) PYRIMIDINE COMPOUNDS NOVEL COMPOUNDS TYMS, DPYD, TPMT CXCR2 195/4885PAK4 328/4885CXCR1 265/4885
US-20050272750-A1 Novel compound SLC10A1, AVPR2, NPC1 CXCR2 156/4885PAK4 1890/4885CXCR1 274/4885
US-20040106628-A1 Novel use CX3CR1, CNR1, ARRB1 CXCR2 24/4885PAK4 3711/4885CXCR1 4/4885
US-20080306262-A1 Novel Compound SLC10A1, AVPR2, NPC1 CXCR2 156/4885PAK4 1890/4885CXCR1 274/4885

“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.