SCHEMBL25311154

SCHEMBL25311154

O=C(CSc1ccncc1)c1ccc(-c2noc(C(F)(F)F)n2)cc1

nearest known ligand 0.60

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 20/20 0.60
HDAC6 Q9UBN7 11/20 0.60
HDAC1 Q13547 1/20 0.50

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
SCHEMBL22531072 0.91 HDAC4 (0.56) HDAC4HDAC6HDAC1
SCHEMBL22530731 0.89 HDAC4 (0.59) HDAC4HDAC6HDAC1
SCHEMBL22530759 0.87 HDAC4 (0.52) HDAC4HDAC6HDAC1
SCHEMBL25312361 0.87 HDAC4 (0.55) HDAC4HDAC6HDAC1
SCHEMBL22530783 0.84 HDAC4 (0.53) HDAC4HDAC6HDAC1
SCHEMBL22530806 0.84 HDAC4 (0.53) HDAC4HDAC6HDAC1
SCHEMBL29391101 0.83 HDAC4 (0.50) HDAC4HDAC6HDAC1
SCHEMBL22530804 0.83 HDAC4 (0.50) HDAC4HDAC6HDAC1
SCHEMBL22531213 0.82 HDAC6 (0.53) HDAC4HDAC6HDAC1
SCHEMBL22530680 0.82 HDAC6 (0.52) HDAC4HDAC6HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113784958-B Oxadiazole compounds for controlling or preventing phytopathogenic fungi PI工业有限公司 2024-04-30 CN claimed
EP-3953341-B1 NOVEL OXADIAZOLE COMPOUNDS FOR CONTROLLING OR PREVENTING PHYTOPATHOGENIC FUNGI PI INDUSTRIES LTD (IN) 2023-07-26 EP claimed
EP-3953341-A1 NOVEL OXADIAZOLE COMPOUNDS FOR CONTROLLING OR PREVENTING PHYTOPATHOGENIC FUNGI PI Industries Ltd. (IN) 2022-02-16 EP claimed
CN-113784958-B Oxadiazole compounds for controlling or preventing phytopathogenic fungi PI工业有限公司 2024-04-30 CN disclosed
EP-3953341-A1 NOVEL OXADIAZOLE COMPOUNDS FOR CONTROLLING OR PREVENTING PHYTOPATHOGENIC FUNGI PI Industries Ltd. (IN) 2022-02-16 EP disclosed