SCHEMBL2332273

SCHEMBL2332273

O=S1(=O)CCOc2c[c]ccc21

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 1/20 0.31
KEAP1 Q14145 1/20 0.31
GPR119 Q8TDV5 1/20 0.31

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
SCHEMBL5659493 0.86 KEAP1 (0.34) MTNR1AKEAP1
SCHEMBL255969 0.73 KEAP1 (0.55) MTNR1AKEAP1
SCHEMBL3766342 0.68 CA1 (0.39)
SCHEMBL31219839 0.68 MAPT (0.44) MTNR1AKEAP1GPR119
SCHEMBL20030 0.68 ITGB2 (0.48)
SCHEMBL27343450 0.66 ITGB2 (0.46)
SCHEMBL3765248 0.66 LMNA (0.36)
SCHEMBL106413 0.65 ITGB2 (0.39)
SCHEMBL5199843 0.64 CA2 (0.33)
SCHEMBL1450521 0.64 CA2 (0.33)

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-1670772-B1 DERIVATIVES OF 1,3-DIONES HAVING A HERBICIDAL ACTIVITY ISAGRO RICERCA SRL (IT) 2011-08-17 EP claimed