SCHEMBL20847653

SCHEMBL20847653

CC(C)N(Cc1ccccc1F)S(=O)(=O)c1c(F)c(F)c(F)c(F)c1F

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 2/20 0.50
CA2 P00918 1/20 0.50
MMP1 P03956 1/20 0.50
MMP2 P08253 1/20 0.50
MMP9 P14780 1/20 0.50
MMP8 P22894 1/20 0.50
MMP13 P45452 1/20 0.50
HDAC3 O15379 1/20 0.50
HDAC11 Q96DB2 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
ALDH1A1 P00352 3/20 0.43
RECQL P46063 1/20 0.41
GAA P10253 1/20 0.40
HTT P42858 1/20 0.40
KEAP1 Q14145 1/20 0.40
KDM4E B2RXH2 1/20 0.39
LMNA P02545 1/20 0.39
TAS2R14 Q9NYV8 2/20 0.39
KMT2A Q03164 1/20 0.38
LIPE Q05469 1/20 0.38

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
SCHEMBL20847640 0.82 HDAC6 (0.48) HDAC8CA2MMP1MMP2MMP9
SCHEMBL20847618 0.81 CA2 (0.45) HDAC8CA2MMP1MMP2MMP9
SCHEMBL20847659 0.75 HDAC6 (0.67) HDAC8HDAC3HDAC11HDAC6ALDH1A1
SCHEMBL20847508 0.74 HDAC6 (0.48) HDAC8CA2MMP1MMP2MMP9
SCHEMBL20847759 0.74 HDAC6 (0.52) HDAC8HDAC3HDAC11HDAC6ALDH1A1
SCHEMBL23783541 0.72 KEAP1 (0.75) HDAC8CA2MMP1MMP2MMP9
SCHEMBL20847721 0.72 RORC (0.48) HDAC8HDAC3HDAC11HDAC6ALDH1A1
SCHEMBL20621832 0.70 TAAR1 (0.50) ALDH1A1RECQLGAAHTTKDM4E
SCHEMBL20847654 0.68 ALDH1A1 (0.38) ALDH1A1RECQLGAAHTTKDM4E
Hydrochloric Acid SCHEMBL27258616 0.67 TAAR1 (0.43) ALDH1A1RECQLGAAHTTKDM4E

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 HDAC8 1916/4885CA2 892/4885MMP1 2883/4885

“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.