SCHEMBL21175476

SCHEMBL21175476

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

nearest known ligand 0.76

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 20/20 0.76
HDAC6 Q9UBN7 8/20 0.65
HDAC8 Q9BY41 2/20 0.62
HDAC1 Q13547 2/20 0.60
HDAC2 Q92769 2/20 0.59
HDAC3 O15379 1/20 0.59
HDAC7 Q8WUI4 1/20 0.59
HDAC5 Q9UQL6 1/20 0.59

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
SCHEMBL14645583 0.86 HDAC4 (1.00) HDAC4HDAC6HDAC8HDAC1HDAC2
SCHEMBL21175471 0.85 HDAC4 (0.67) HDAC4HDAC6HDAC8HDAC1HDAC2
SCHEMBL21187809 0.85 HDAC4 (0.64) HDAC4HDAC6HDAC8HDAC1HDAC2
SCHEMBL21175514 0.85 HDAC4 (0.79) HDAC4HDAC6HDAC8HDAC1HDAC2
SCHEMBL21175510 0.83 HDAC4 (0.67) HDAC4HDAC6HDAC8HDAC1HDAC2
SCHEMBL20049299 0.83 HDAC4 (0.66) HDAC4HDAC6HDAC8
SCHEMBL20593560 0.82 HDAC4 (0.67) HDAC4HDAC6HDAC8HDAC1
SCHEMBL21175499 0.82 HDAC4 (0.64) HDAC4HDAC6HDAC8HDAC1
SCHEMBL19100119 0.81 HDAC4 (0.72) HDAC4HDAC6HDAC8HDAC1HDAC2
SCHEMBL20593780 0.81 HDAC4 (0.69) HDAC4HDAC6HDAC8HDAC1HDAC2

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
EP-3522715-B1 MICROBIOCIDAL OXADIAZOLE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2021-01-20 EP disclosed
US-10653146-B2 Microbiocidal oxadiazole derivatives SYNGENTA PARTICIPATIONS AG (CH) 2020-05-19 US disclosed
US-10653146-B2 Microbiocidal oxadiazole derivatives SYNGENTA PARTICIPATIONS AG (CH) 2020-05-19 US disclosed
US-20190223442-A1 MICROBIOCIDAL OXADIAZOLE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2019-07-25 US disclosed
US-20190223442-A1 MICROBIOCIDAL OXADIAZOLE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2019-07-25 US 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 (2 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-20190223442-A1 MICROBIOCIDAL OXADIAZOLE DERIVATIVES NOX3, NOX1, MPO HDAC4 1299/4885HDAC6 676/4885HDAC8 1669/4885
US-10653146-B2 Microbiocidal oxadiazole derivatives NOX3, NOX1, MPO HDAC4 1299/4885HDAC6 676/4885HDAC8 1669/4885

“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.