SCHEMBL7500288

SCHEMBL7500288

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

nearest known ligand 0.76

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 20/20 0.76
CX3CR1 P49238 5/20 0.72
HTR1B P28222 1/20 0.64

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
SCHEMBL841755 1.00 CXCR2 (0.76) CXCR2CX3CR1HTR1B
SCHEMBL842524 0.88 CXCR2 (0.86) CXCR2CX3CR1HTR1B
SCHEMBL841899 0.86 CXCR2 (1.00) CXCR2CX3CR1HTR1B
SCHEMBL841617 0.86 CXCR2 (0.98) CXCR2CX3CR1HTR1B
SCHEMBL841616 0.86 CXCR2 (0.98) CXCR2CX3CR1HTR1B
SCHEMBL4711342 0.85 CXCR2 (0.83) CXCR2CX3CR1HTR1B
SCHEMBL5436819 0.83 CXCR2 (1.00) CXCR2CX3CR1HTR1B
SCHEMBL7141864 0.83 CXCR2 (0.81) CXCR2CX3CR1HTR1B
SCHEMBL4489772 0.83 CXCR2 (0.78) CXCR2CX3CR1
SCHEMBL841838 0.83 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1222195-A1 NOVEL THIAZOLO(4,5-D)PYRIMIDINE COMPOUNDS AstraZeneca UK Limited (GB) 2002-07-17 EP disclosed
WO-2001025242-A1 NOVEL THIAZOLO(4,5-D)PYRIMIDINE COMPOUNDS ASTRAZENECA UK LIMITED (GB) 2001-04-12 WO disclosed