SCHEMBL6619610

SCHEMBL6619610

CC(CNc1nc(SCc2cccc(F)c2F)nc2[nH]c(=O)sc12)N(C)C

nearest known ligand 0.69

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 20/20 0.69
CX3CR1 P49238 3/20 0.65
HTR1B P28222 1/20 0.58

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
SCHEMBL842397 0.87 CXCR2 (0.77) CXCR2CX3CR1HTR1B
Hydrochloric Acid SCHEMBL841595 0.86 CXCR2 (0.76) CXCR2CX3CR1HTR1B
SCHEMBL842350 0.84 CXCR2 (0.80) CXCR2CX3CR1HTR1B
SCHEMBL842874 0.83 CXCR2 (0.68) CXCR2CX3CR1HTR1B
SCHEMBL5036023 0.82 CXCR2 (0.70) CXCR2CX3CR1HTR1B
SCHEMBL842296 0.82 CXCR2 (0.72) CXCR2CX3CR1HTR1B
SCHEMBL841838 0.82 CXCR2 (0.83) CXCR2CX3CR1HTR1B
SCHEMBL841899 0.82 CXCR2 (1.00) CXCR2CX3CR1HTR1B
SCHEMBL13140053 0.81 CXCR2 (0.70) CXCR2CX3CR1HTR1B
SCHEMBL841616 0.81 CXCR2 (0.98) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1222195-B1 NOVEL THIAZOLO(4,5-D)PYRIMIDINE COMPOUNDS ASTRAZENECA UK LTD (GB) 2004-01-14 EP claimed