SCHEMBL29334244

SCHEMBL29334244

C=CC(=O)N1[C@H](C)COC[C@H]1c1cc(Cl)cc(Cl)c1

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KRAS P01116 3/20 0.35
HCRTR2 O43614 5/20 0.32
GSK3B P49841 1/20 0.31
CCKBR P32239 2/20 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
SCHEMBL29334350 0.92 KRAS (0.40) KRASHCRTR2
SCHEMBL30855210 0.92 KRAS (0.40) KRASHCRTR2
SCHEMBL29334243 0.87 KRAS (0.34) KRAS
SCHEMBL29333403 0.86 SLC6A7 (0.34) KRASGSK3BCCKBR
SCHEMBL29334349 0.85 KRAS (0.30) KRAS
SCHEMBL31008574 0.83 JAK3 (0.31)
SCHEMBL29333558 0.83 JAK3 (0.31)
SCHEMBL29333408 0.82 PIK3C3 (0.33) GSK3B
SCHEMBL31008645 0.82 JAK2 (0.33) KRAS
SCHEMBL29333564 0.82 MTOR (0.37) GSK3BCCKBR

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-20240226114-A1 INHIBITORS AND USES THEREOF VIVIDION THERAPEUTICS, INC. 2024-07-11 US disclosed
US-20240226114-A1 INHIBITORS AND USES THEREOF VIVIDION THERAPEUTICS, INC. 2024-07-11 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-20240226114-A1 INHIBITORS AND USES THEREOF KEAP1, NQO1, NFE2L2 KRAS 531/4885HCRTR2 3315/4885GSK3B 495/4885

“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.