SCHEMBL29637394

SCHEMBL29637394

CC(C)(C)OC(=O)NC(=S)NC1CC2(COC2)C1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.46
NFKB1 P19838 1/20 0.35
NFKB2 Q00653 1/20 0.35
RELA Q04206 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
BTK Q06187 1/20 0.35
MEN1 O00255 1/20 0.34
MAPK1 P28482 1/20 0.34
KMT2A Q03164 1/20 0.34
EPHX1 P07099 1/20 0.33
CTSK P43235 2/20 0.33
EPHX2 P34913 1/20 0.31
RECQL P46063 1/20 0.30

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
SCHEMBL28547494 0.81 GAA (0.49) GAANFKB1NFKB2RELACA1
SCHEMBL28536966 0.78 GAA (0.56) GAANFKB1NFKB2RELACA1
SCHEMBL28536965 0.77 GAA (0.46) GAANFKB1NFKB2RELACA1
SCHEMBL28534993 0.77 GAA (0.46) GAANFKB1NFKB2RELACA1
SCHEMBL23148614 0.77 RECQL (0.33) RECQL
SCHEMBL28542561 0.76 GAA (0.45) GAANFKB1NFKB2RELACA1
SCHEMBL28551448 0.75 GAA (0.50) GAANFKB1NFKB2RELACA1
SCHEMBL28547490 0.74 GAA (0.77) GAACA1CA2BTKMEN1
SCHEMBL28547492 0.74 GAA (0.51) GAANFKB1NFKB2RELACA1
SCHEMBL29810609 0.74 GAA (0.48) GAANFKB1NFKB2RELACA1

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-11479546-B2 Antimalarial hexahydropyrimidine analogues UCB Biopharma SRL 2022-10-25 US disclosed
EP-3774741-B1 ANTIMALARIAL HEXAHYDROPYRIMIDINE ANALOGUES UCB Biopharma SRL (BE) 2022-06-08 EP 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-11479546-B2 Antimalarial hexahydropyrimidine analogues G6PD, DPYD, DHODH GAA 3464/4885NFKB1 3697/4885NFKB2 4290/4885

“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.