SCHEMBL29199024

SCHEMBL29199024

Fc1[c]ccc(-c2noc(C(F)(F)F)n2)c1

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 18/20 0.46
HDAC1 Q13547 9/20 0.46
HDAC5 Q9UQL6 2/20 0.46
HDAC4 P56524 8/20 0.45
HDAC8 Q9BY41 6/20 0.44

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
SCHEMBL28659405 0.84 HDAC4 (0.47) HDAC6HDAC1HDAC5HDAC4HDAC8
SCHEMBL6345954 0.79 HDAC4 (0.54) HDAC6HDAC1HDAC4HDAC8
SCHEMBL28659384 0.78 HDAC4 (0.42) HDAC6HDAC1HDAC4HDAC8
SCHEMBL28673442 0.78 HDAC6 (0.45) HDAC6HDAC1HDAC5HDAC4HDAC8
SCHEMBL28678983 0.78 HDAC6 (0.53) HDAC6HDAC1HDAC5HDAC4HDAC8
SCHEMBL28656017 0.77 HDAC4 (0.44) HDAC6HDAC1HDAC4
SCHEMBL18824382 0.77 HDAC6 (0.59) HDAC6HDAC1HDAC5HDAC4HDAC8
SCHEMBL28669778 0.77 HDAC6 (0.42) HDAC6HDAC1HDAC5HDAC4HDAC8
SCHEMBL18824381 0.76 HDAC4 (0.66) HDAC6HDAC1HDAC4HDAC8
SCHEMBL28676799 0.76 HDAC6 (0.45) HDAC6HDAC1HDAC5HDAC4HDAC8

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
CN-113784958-B Oxadiazole compounds for controlling or preventing phytopathogenic fungi PI工业有限公司 2024-04-30 CN claimed
CN-113784958-B Oxadiazole compounds for controlling or preventing phytopathogenic fungi PI工业有限公司 2024-04-30 CN disclosed