SCHEMBL21223409

SCHEMBL21223409

CN(C(=O)c1ccc(-c2noc(C(F)(F)F)n2)cc1)S(=O)(=O)C(F)(F)F

nearest known ligand 0.73

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 20/20 0.73
HDAC6 Q9UBN7 8/20 0.64
HDAC8 Q9BY41 2/20 0.64
HDAC2 Q92769 2/20 0.64
HDAC1 Q13547 2/20 0.60
HDAC3 O15379 1/20 0.60
HDAC7 Q8WUI4 1/20 0.60
HDAC5 Q9UQL6 1/20 0.60

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
SCHEMBL21223701 0.93 HDAC4 (0.70) HDAC4HDAC6HDAC8HDAC2HDAC1
SCHEMBL14645583 0.84 HDAC4 (1.00) HDAC4HDAC6HDAC8HDAC2HDAC1
SCHEMBL21223349 0.83 HDAC4 (0.71) HDAC4HDAC6HDAC8HDAC2HDAC1
SCHEMBL21223467 0.83 HDAC4 (0.70) HDAC4HDAC6HDAC8HDAC2HDAC1
SCHEMBL14645607 0.82 HDAC4 (1.00) HDAC4HDAC6HDAC8HDAC2HDAC1
SCHEMBL21223842 0.82 HDAC4 (0.64) HDAC4HDAC6HDAC8HDAC2HDAC1
SCHEMBL21223530 0.82 HDAC4 (0.64) HDAC4HDAC6HDAC8HDAC2HDAC1
SCHEMBL21223599 0.81 HDAC4 (0.70) HDAC4HDAC6HDAC8HDAC2HDAC1
SCHEMBL20838051 0.81 HDAC4 (0.78) HDAC4HDAC6HDAC8HDAC2HDAC1
SCHEMBL19030803 0.80 HDAC4 (0.76) HDAC4HDAC6HDAC8HDAC2HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11286242-B2 Oxadiazoles for use in controlling phytopathogenic fungi PI INDUSTRIES LTD. (IN) 2022-03-29 US claimed
CN-112004813-A Oxadiazole compounds for controlling phytopathogenic fungi PI工业有限公司 2020-11-27 CN claimed
US-20200354326-A1 OXADIAZOLES FOR USE IN CONTROLLING PHYTOPATHOGENIC FUNGI PI INDUSTRIES LTD. (IN) 2020-11-12 US claimed
WO-2019150219-A9 OXADIAZOLES FOR USE IN CONTROLLING PHYTOPATHOGENIC FUNGI PI INDUSTRIES LTD. (IN) 2019-11-28 WO claimed
US-20220169621-A1 OXADIAZOLES FOR USE IN CONTROLLING PHYTOPATHOGENIC FUNGI PI INDUSTRIES LTD. (IN) 2022-06-02 US disclosed
US-11286242-B2 Oxadiazoles for use in controlling phytopathogenic fungi PI INDUSTRIES LTD. (IN) 2022-03-29 US disclosed
EP-3746439-A2 OXADIAZOLES FOR USE IN CONTROLLING PHYTOPATHOGENIC FUNGI PI Industries Ltd. (IN) 2020-12-09 EP disclosed
CN-112004813-A Oxadiazole compounds for controlling phytopathogenic fungi PI工业有限公司 2020-11-27 CN disclosed
US-20200354326-A1 OXADIAZOLES FOR USE IN CONTROLLING PHYTOPATHOGENIC FUNGI PI INDUSTRIES LTD. (IN) 2020-11-12 US disclosed
WO-2019150219-A9 OXADIAZOLES FOR USE IN CONTROLLING PHYTOPATHOGENIC FUNGI PI INDUSTRIES LTD. (IN) 2019-11-28 WO disclosed
WO-2019150219-A2 NOVEL OXADIAZOLES PI INDUSTRIES LTD. (IN) 2019-08-08 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11286242-B2 Oxadiazoles for use in controlling phytopathogenic fungi OXA1L, CYP51A1, CYP1A1 HDAC4 2246/4885HDAC6 1374/4885HDAC8 2756/4885
US-20200354326-A1 OXADIAZOLES FOR USE IN CONTROLLING PHYTOPATHOGENIC FUNGI OXA1L, CYP51A1, CYP1A1 HDAC4 2246/4885HDAC6 1374/4885HDAC8 2756/4885
US-20220169621-A1 OXADIAZOLES FOR USE IN CONTROLLING PHYTOPATHOGENIC FUNGI OXA1L, CYP51A1, CYP1A1 HDAC4 2246/4885HDAC6 1374/4885HDAC8 2756/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.