SCHEMBL28660671

SCHEMBL28660671

FC(F)(F)c1ccc(Sc2[c]ccc(-c3noc(C(F)(F)Cl)n3)c2)cc1Cl

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 15/20 0.35
HDAC1 Q13547 11/20 0.35
CASP3 P42574 1/20 0.35
HDAC4 P56524 8/20 0.34
MAPT P10636 1/20 0.34
HDAC8 Q9BY41 2/20 0.32
S1PR1 P21453 1/20 0.31
HDAC5 Q9UQL6 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
SCHEMBL28654901 0.85 HDAC6 (0.41) HDAC6HDAC1HDAC4HDAC8HDAC5
SCHEMBL28663157 0.81 HDAC6 (0.44) HDAC6HDAC1HDAC4HDAC8HDAC5
SCHEMBL28663168 0.80 S1PR1 (0.36) HDAC6HDAC1CASP3HDAC4MAPT
SCHEMBL28669778 0.78 HDAC6 (0.42) HDAC6HDAC1HDAC4HDAC8HDAC5
SCHEMBL28673815 0.78 HDAC6 (0.36) HDAC6HDAC1CASP3HDAC4HDAC8
SCHEMBL28654906 0.78 HDAC6 (0.46) HDAC6HDAC1HDAC4HDAC8HDAC5
SCHEMBL28660667 0.78 HDAC6 (0.35) HDAC6HDAC1CASP3HDAC4MAPT
SCHEMBL28661333 0.76 HDAC6 (0.44) HDAC6HDAC1HDAC4HDAC8HDAC5
SCHEMBL28676799 0.76 HDAC6 (0.45) HDAC6HDAC1HDAC4HDAC8HDAC5
SCHEMBL28666245 0.76 HDAC4 (0.33) HDAC6HDAC1HDAC4HDAC8

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 4 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-A Novel oxadiazole compounds for controlling or preventing phytopathogenic fungi PI工业有限公司 2021-12-10 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
CN-113784958-A Novel oxadiazole compounds for controlling or preventing phytopathogenic fungi PI工业有限公司 2021-12-10 CN disclosed