SCHEMBL22531007

SCHEMBL22531007

COc1ccc(CS(=O)(=O)Cc2cn3cc(-c4noc(C(F)(F)F)n4)ccc3n2)cc1

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 19/20 0.44
HDAC1 Q13547 9/20 0.44
HDAC8 Q9BY41 4/20 0.44
HDAC4 P56524 12/20 0.43
HDAC5 Q9UQL6 6/20 0.42

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
SCHEMBL22531890 0.88 HDAC6 (0.42) HDAC6HDAC1HDAC8HDAC4HDAC5
SCHEMBL29381515 0.88 HDAC6 (0.46) HDAC6HDAC1HDAC8HDAC4HDAC5
SCHEMBL29381997 0.83 HDAC6 (0.46) HDAC6HDAC1HDAC8HDAC4HDAC5
SCHEMBL23013926 0.81 HDAC6 (0.44) HDAC6HDAC1HDAC8HDAC4HDAC5
SCHEMBL29379542 0.81 MAPT (0.51) HDAC6HDAC1HDAC8HDAC4HDAC5
SCHEMBL29381424 0.80 HDAC4 (0.57) HDAC6HDAC1HDAC8HDAC4HDAC5
SCHEMBL22530751 0.77 HDAC4 (0.53) HDAC6HDAC1HDAC8HDAC4HDAC5
SCHEMBL22531035 0.77 HDAC6 (0.49) HDAC6HDAC1HDAC8HDAC4HDAC5
SCHEMBL29379086 0.76 HDAC6 (0.41) HDAC6HDAC1HDAC8HDAC4HDAC5
SCHEMBL29382124 0.75 HDAC4 (0.53) HDAC6HDAC1HDAC8HDAC4

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3953353-A1 NOVEL OXADIAZOLE COMPOUNDS FOR CONTROLLING OR PREVENTING PHYTOPATHOGENIC FUNGI PI Industries Ltd. (IN) 2022-02-16 EP claimed
EP-3953353-A1 NOVEL OXADIAZOLE COMPOUNDS FOR CONTROLLING OR PREVENTING PHYTOPATHOGENIC FUNGI PI Industries Ltd. (IN) 2022-02-16 EP disclosed
WO-2020208510-A1 NOVEL OXADIAZOLE COMPOUNDS FOR CONTROLLING OR PREVENTING PHYTOPATHOGENIC FUNGI PI INDUSTRIES LIMITED (IN) 2020-10-15 WO disclosed