SCHEMBL20847486

SCHEMBL20847486

CC(C)(C)OC(=O)Nc1ccc(-c2ccccc2C=O)cc1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP17A1 P05093 4/20 0.51
PSMB8 P28062 1/20 0.49
BRD4 O60885 1/20 0.48
CREBBP Q92793 1/20 0.48
MAP4K4 O95819 1/20 0.46
NAMPT P43490 1/20 0.43
IDO1 P14902 1/20 0.43
BCL2 P10415 5/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA9 Q16790 1/20 0.41
DRD2 P14416 1/20 0.41
LIPE Q05469 1/20 0.41
BECN1 Q14457 2/20 0.41
PRKDC P78527 1/20 0.39
CD274 Q9NZQ7 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
SCHEMBL30231333 0.82 CYP17A1 (0.59) CYP17A1PSMB8BRD4CREBBPMAP4K4
SCHEMBL29096680 0.82 CYP17A1 (0.59) CYP17A1PSMB8BRD4CREBBPMAP4K4
SCHEMBL3790541 0.81 CYP17A1 (0.50) CYP17A1PSMB8BRD4CREBBPMAP4K4
SCHEMBL15139200 0.80 CYP17A1 (0.52) CYP17A1PSMB8BRD4CREBBPMAP4K4
SCHEMBL18570243 0.79 CYP17A1 (0.61) CYP17A1PSMB8MAP4K4NAMPTBCL2
SCHEMBL20865536 0.79 CYP17A1 (0.68) CYP17A1PSMB8BRD4CREBBPMAP4K4
SCHEMBL7094083 0.78 LMNA (0.52) CYP17A1PSMB8BRD4CREBBPMAP4K4
SCHEMBL6165687 0.78 BRD4 (0.48) CYP17A1PSMB8BRD4CREBBPMAP4K4
SCHEMBL6164154 0.78 BRD4 (0.48) CYP17A1PSMB8BRD4CREBBPMAP4K4
SCHEMBL6164774 0.78 TTK (0.55) CYP17A1PSMB8BRD4CREBBPMAP4K4

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 CYP17A1 1299/4885PSMB8 2899/4885BRD4 2520/4885

“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.