SCHEMBL19746418

SCHEMBL19746418

O=c1cc(-c2noc(C(F)(F)F)n2)ccn1Cc1ccccc1F

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 19/20 0.57
HDAC1 Q13547 15/20 0.54
HDAC8 Q9BY41 9/20 0.51
HDAC5 Q9UQL6 5/20 0.51
HDAC4 P56524 3/20 0.51
HDAC3 O15379 1/20 0.51
HDAC7 Q8WUI4 1/20 0.51
HDAC2 Q92769 1/20 0.51
HDAC10 Q969S8 1/20 0.51
HDAC11 Q96DB2 1/20 0.51
HDAC9 Q9UKV0 1/20 0.51

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
SCHEMBL19746498 0.92 HDAC6 (0.50) HDAC6HDAC1HDAC8HDAC5HDAC4
SCHEMBL19746960 0.88 HDAC6 (0.52) HDAC6HDAC1HDAC8HDAC5HDAC4
SCHEMBL19746092 0.88 HDAC6 (0.46) HDAC6HDAC1HDAC8HDAC5HDAC4
SCHEMBL19746870 0.87 HDAC6 (0.48) HDAC6HDAC1HDAC8HDAC5HDAC4
SCHEMBL19746215 0.87 HDAC6 (0.51) HDAC6HDAC1HDAC8HDAC5HDAC4
SCHEMBL19746301 0.86 HDAC6 (0.48) HDAC6HDAC1HDAC8HDAC5HDAC4
SCHEMBL19747196 0.86 HDAC6 (0.53) HDAC6HDAC1HDAC8HDAC5HDAC4
SCHEMBL19746970 0.85 HDAC6 (0.52) HDAC6HDAC1HDAC8HDAC5HDAC4
SCHEMBL19746376 0.84 HDAC6 (0.50) HDAC6HDAC1HDAC8HDAC5HDAC4
SCHEMBL19745968 0.83 HDAC6 (0.46) HDAC6HDAC1HDAC8HDAC5HDAC4

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
WO-2017222952-A1 3- HETEROARYL SUBSTITUTED 5-TRIFLUOROMETHYL OXADIAZOLES AS HISTONE DEACETYLASE 6 (HDAC6) INHIBITORS MERCK SHARP & DOHME CORP. (US) 2017-12-28 WO claimed
US-11708358-B2 Fungicidal oxadiazoles FMC CORPORATION (US) 2023-07-25 US disclosed
US-11708358-B2 Fungicidal oxadiazoles FMC CORPORATION (US) 2023-07-25 US disclosed
US-20200148672-A1 FUNGICIDAL OXADIAZOLES FMC CORPORATION 2020-05-14 US disclosed
WO-2017222952-A1 3- HETEROARYL SUBSTITUTED 5-TRIFLUOROMETHYL OXADIAZOLES AS HISTONE DEACETYLASE 6 (HDAC6) INHIBITORS MERCK SHARP & DOHME CORP. (US) 2017-12-28 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 (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-20200148672-A1 FUNGICIDAL OXADIAZOLES OXA1L, NOX1, TH HDAC6 1038/4885HDAC1 1586/4885HDAC8 2957/4885
US-11708358-B2 Fungicidal oxadiazoles OXA1L, NOX1, TH HDAC6 1038/4885HDAC1 1586/4885HDAC8 2957/4885

“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.