SCHEMBL25183271

SCHEMBL25183271

CC(C)(C)OC(=O)NC(=O)Oc1ncc(N)cn1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NFKB1 P19838 1/20 0.35
NFKB2 Q00653 1/20 0.35
RELA Q04206 1/20 0.35
MAPKAPK2 P49137 6/20 0.34
MAP4K4 O95819 1/20 0.34
TSHR P16473 1/20 0.34
FSHR P23945 1/20 0.34
TRPA1 O75762 1/20 0.33
STK17B O94768 1/20 0.33
STK17A Q9UEE5 1/20 0.33
ATR Q13535 1/20 0.33
RAB9A P51151 1/20 0.33
CSNK1D P48730 1/20 0.32

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
SCHEMBL14854850 0.79 TSHR (0.43) NFKB1NFKB2RELAMAPKAPK2MAP4K4
SCHEMBL25274470 0.79 AAK1 (0.41) NFKB1NFKB2RELAMAPKAPK2MAP4K4
SCHEMBL24756661 0.72 MAPKAPK2 (0.44) MAPKAPK2STK17BSTK17ACSNK1D
SCHEMBL22234711 0.71 GAA (0.45) TSHRFSHRTRPA1RAB9A
SCHEMBL101218 0.71 DGAT1 (0.46) NFKB1NFKB2RELA
SCHEMBL28048189 0.70 CYP19A1 (0.36) TSHR
SCHEMBL22778721 0.69 GAA (0.47) RAB9A
SCHEMBL7159196 0.69 ALDH1A1 (0.37)
SCHEMBL56219 0.69 PTGS1 (0.50) MAPKAPK2MAP4K4ATRRAB9A
SCHEMBL23204225 0.69 ADORA2A (0.47) STK17BSTK17ACSNK1D

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230150946-A1 HETEROCYCLE CONTAINING STAT INHIBITORS AND COMPOSITIONS OXFORD FINANCE LLC 2023-05-18 US 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-20230150946-A1 HETEROCYCLE CONTAINING STAT INHIBITORS AND COMPOSITIONS STAT5A, STAT5B, STAT3 NFKB1 39/4885NFKB2 149/4885RELA 11/4885

“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.