SCHEMBL20847599

SCHEMBL20847599

COC(=O)c1ccc(CN(C2CC2)S(=O)(=O)c2c(F)c(F)c(F)c(F)c2F)cc1

nearest known ligand 0.73

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HDAC6 Q9UBN7 18/20 0.73
▸ HDAC8 Q9BY41 14/20 0.73
▸ HDAC11 Q96DB2 7/20 0.73
▸ HDAC3 O15379 4/20 0.73
▸ MEN1 O00255 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ PSEN1 P49768 1/20 0.45
▸ PSEN2 P49810 1/20 0.45
▸ APH1B Q8WW43 1/20 0.45
▸ NCSTN Q92542 1/20 0.45
▸ APH1A Q96BI3 1/20 0.45
▸ PSENEN Q9NZ42 1/20 0.45

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
SCHEMBL20847509 0.95 HDAC6 (0.67) HDAC6HDAC8HDAC11HDAC3MEN1
SCHEMBL20839241 0.85 HDAC6 (0.76) HDAC6HDAC8HDAC11HDAC3MEN1
SCHEMBL22482909 0.84 HDAC6 (1.00) HDAC6HDAC8HDAC11HDAC3
SCHEMBL20847479 0.84 HDAC6 (0.74) HDAC6HDAC8HDAC11HDAC3MEN1
SCHEMBL20847784 0.83 HDAC6 (0.63) HDAC6HDAC8HDAC11HDAC3MEN1
SCHEMBL20847546 0.83 HDAC6 (0.61) HDAC6HDAC8HDAC11HDAC3MEN1
SCHEMBL20847554 0.81 HDAC6 (0.69) HDAC6HDAC8HDAC11HDAC3MEN1
SCHEMBL20847550 0.81 HDAC6 (0.68) HDAC6HDAC8HDAC11HDAC3MEN1
SCHEMBL14842844 0.80 MEN1 (0.76) HDAC6HDAC8HDAC3MEN1KMT2A
SCHEMBL20847603 0.78 HDAC6 (0.65) HDAC6HDAC8HDAC11HDAC3MEN1

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
US-20200277268-A1 PENTAFLUOROPHENYL SULFONAMIDE COMPOUNDS, COMPOSITIONS AND USES THEREOF DALRIADA THERAPEUTICS INC. (CA) 2020-09-03 — — US disclosed
WO-2019056120-A1 PENTAFLUOROPHENYL SULFONAMIDE COMPOUNDS, COMPOSITIONS AND USES THEREOF DALRIADA THERAPEUTICS INC. (CA) 2019-03-28 — — 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 (1 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-20200277268-A1 PENTAFLUOROPHENYL SULFONAMIDE COMPOUNDS, COMPOSITIONS AND USES THEREOF MKI67, PKD1, ETV6 HDAC6 499/4885HDAC8 1916/4885HDAC11 1481/4885

“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.

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