SCHEMBL8556572

SCHEMBL8556572

Cc1cc(F)ccc1C=S

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 3/20 0.41
PTGS1 P23219 2/20 0.41
NFE2L2 Q16236 6/20 0.40
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
KCNH2 Q12809 1/20 0.38
ACHE P22303 2/20 0.35
ALOX5 P09917 1/20 0.34
MPO P05164 1/20 0.34
HCAR1 Q9BXC0 1/20 0.34
GRIN2D O15399 1/20 0.32
GRIN3B O60391 1/20 0.32
GRIN1 Q05586 1/20 0.32
GRIN2A Q12879 1/20 0.32
GRIN2B Q13224 1/20 0.32
GRIN2C Q14957 1/20 0.32
GRIN3A Q8TCU5 1/20 0.32
KDM4E B2RXH2 1/20 0.32
BACE1 P56817 1/20 0.32

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
SCHEMBL7826401 0.82 PTGS1 (0.41) PTGS2PTGS1NFE2L2ACHEALOX5
SCHEMBL867378 0.77 PTGS2 (0.41) PTGS2PTGS1NFE2L2HTR2AHTR2C
SCHEMBL1350147 0.77 ALDH1A1 (0.48) PTGS2PTGS1NFE2L2HTR2AHTR2C
SCHEMBL2949202 0.76 AMY1A (0.44) KDM4EBACE1
SCHEMBL13678718 0.76 PTGS1 (0.43) PTGS2PTGS1NFE2L2HTR2AHTR2C
SCHEMBL18906997 0.76 PTGS1 (0.43) PTGS2PTGS1NFE2L2HTR2AHTR2C
SCHEMBL20125001 0.74 PTGS1 (0.46) PTGS2PTGS1NFE2L2HTR2AHTR2C
SCHEMBL28757498 0.74 PTGS2 (0.39) PTGS2PTGS1NFE2L2HTR2AHTR2C
SCHEMBL19677216 0.74 PTGS1 (0.42) PTGS2PTGS1NFE2L2HTR2AHTR2C
SCHEMBL2097320 0.74 PTGS2 (0.42) PTGS2PTGS1NFE2L2HTR2AHTR2C

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-0816362-A1 THIAZOLE DERIVATIVES TAISHO PHARMACEUTICAL CO. LTD (JP) 1998-01-07 EP disclosed