SCHEMBL5299127

SCHEMBL5299127

COCCS(=O)(=O)c1nc(OCC(=O)O)ns1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 1/20 0.32
PTGDR2 Q9Y5Y4 1/20 0.30

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
SCHEMBL5288284 0.69 TXNRD1 (0.47)
SCHEMBL5362184 0.64 NPC1 (0.40)
SCHEMBL5297823 0.63 KMT2A (0.35)
SCHEMBL5293941 0.62 TXNRD1 (0.43)
SCHEMBL13173072 0.57 TSHR (0.42)
SCHEMBL163450 0.57 HTT (0.51)
SCHEMBL5355158 0.57 LMNA (0.51)
SCHEMBL9436183 0.56 ALOX15 (0.40)
SCHEMBL20320644 0.56 TSHR (0.36)
SCHEMBL2844487 0.56 KDM4E (0.50) PTGDR2

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
WO-2007012724-A1 1,2,4-THIADIAZOLE DERIVATIVES ANTIFUNGAL COMPOUNDS, COMPOSITIONS CONTAINING SAID COMPOUNDS AND THE USE THEREOF CYTOMICS SYSTEMS (FR) 2007-02-01 WO claimed
WO-2007012724-A1 1,2,4-THIADIAZOLE DERIVATIVES ANTIFUNGAL COMPOUNDS, COMPOSITIONS CONTAINING SAID COMPOUNDS AND THE USE THEREOF CYTOMICS SYSTEMS (FR) 2007-02-01 WO disclosed