SCHEMBL20847488

SCHEMBL20847488

CC(C)(C)OC(=O)Nc1ccc(-c2ccccc2CNC2CC2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.48
CREBBP Q92793 1/20 0.48
CYP17A1 P05093 2/20 0.45
SLC6A2 P23975 1/20 0.42
SLC6A4 P31645 1/20 0.42
SLC6A3 Q01959 1/20 0.42
CD274 Q9NZQ7 1/20 0.41
PSMB8 P28062 1/20 0.41
BCL2 P10415 5/20 0.41
BECN1 Q14457 4/20 0.41
DRD2 P14416 1/20 0.41
IDO1 P14902 1/20 0.41
NAMPT P43490 1/20 0.40
PTPN2 P17706 1/20 0.40
PTPN1 P18031 1/20 0.40
PTPN6 P29350 1/20 0.40
SYK P43405 1/20 0.39
MEN1 O00255 1/20 0.39
ABL1 P00519 1/20 0.39
POLB P06746 1/20 0.39

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
SCHEMBL20843607 0.82 SLC6A2 (0.51) SLC6A2SLC6A4SLC6A3CD274MEN1
SCHEMBL3790541 0.74 CYP17A1 (0.50) BRD4CREBBPCYP17A1PSMB8BCL2
SCHEMBL31455183 0.74 CYP17A1 (0.46) CYP17A1DRD2NAMPTSYKMEN1
SCHEMBL15139200 0.73 CYP17A1 (0.52) BRD4CREBBPCYP17A1CD274PSMB8
SCHEMBL15912422 0.73 SYK (0.54) BRD4CREBBPCYP17A1PSMB8DRD2
SCHEMBL18570243 0.73 CYP17A1 (0.61) CYP17A1CD274PSMB8BCL2BECN1
SCHEMBL4126621 0.73 USP30 (0.56) BRD4SLC6A2SLC6A4SLC6A3
SCHEMBL4141424 0.73 USP30 (0.56) BRD4SLC6A2SLC6A4SLC6A3
SCHEMBL5872547 0.72 SLC6A2 (0.69) SLC6A2SLC6A4SLC6A3CD274MEN1
SCHEMBL20847489 0.72 HDAC6 (0.43) BRD4CREBBPCYP17A1SLC6A2SLC6A4

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 BRD4 2520/4885CREBBP 3480/4885CYP17A1 1299/4885

“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.