SCHEMBL7141864

SCHEMBL7141864

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

nearest known ligand 0.81

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 20/20 0.81
CX3CR1 P49238 6/20 0.81
HTR1B P28222 1/20 0.65

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
SCHEMBL842524 0.93 CXCR2 (0.86) CXCR2CX3CR1HTR1B
SCHEMBL5436819 0.90 CXCR2 (1.00) CXCR2CX3CR1HTR1B
SCHEMBL841899 0.88 CXCR2 (1.00) CXCR2CX3CR1HTR1B
SCHEMBL29501084 0.88 CXCR2 (1.00) CXCR2CX3CR1HTR1B
SCHEMBL29366739 0.88 CXCR2 (1.00) CXCR2CX3CR1HTR1B
SCHEMBL841616 0.87 CXCR2 (0.98) CXCR2CX3CR1HTR1B
SCHEMBL841617 0.87 CXCR2 (0.98) CXCR2CX3CR1HTR1B
SCHEMBL4711342 0.86 CXCR2 (0.83) CXCR2CX3CR1HTR1B
SCHEMBL7500288 0.83 CXCR2 (0.76) CXCR2CX3CR1HTR1B
SCHEMBL841755 0.83 CXCR2 (0.76) 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-1348709-A2 Thiazolo (4,5-D) pyrimidine compounds AstraZeneca UK Limited (GB) 2003-10-01 EP disclosed