SCHEMBL31008618

SCHEMBL31008618

C=CC(=O)N1CCOC[C@H]1c1cc(Cl)cc(-c2cc(N)nc(Cl)n2)c1

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.34
▸ CCNC P24863 1/20 0.33
▸ CDK8 P49336 1/20 0.33
▸ PIK3CA P42336 1/20 0.31
▸ BTK Q06187 3/20 0.30
▸ EGFR P00533 2/20 0.30
▸ BMX P51813 2/20 0.30
▸ ITK Q08881 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
SCHEMBL29333783 1.00 MAPK1 (0.34) MAPK1CCNCCDK8PIK3CABTK
SCHEMBL29333796 0.91 MAPK1 (0.33) MAPK1CCNCCDK8PIK3CABTK
SCHEMBL30855181 0.91 MAPK1 (0.33) MAPK1CCNCCDK8PIK3CABTK
SCHEMBL29333491 0.87 JAK2 (0.35) MAPK1CCNCCDK8BTKEGFR
SCHEMBL31008588 0.87 JAK2 (0.35) MAPK1CCNCCDK8BTKEGFR
SCHEMBL29333751 0.86 MAPK1 (0.35) MAPK1CCNCCDK8PIK3CABTK
SCHEMBL31008544 0.86 MAPK1 (0.35) MAPK1CCNCCDK8PIK3CABTK
SCHEMBL29333555 0.86 CCNC (0.35) MAPK1CCNCCDK8PIK3CABTK
SCHEMBL31008554 0.86 CCNC (0.35) MAPK1CCNCCDK8PIK3CABTK
SCHEMBL30855080 0.86 SCD5 (0.33) MAPK1CCNCCDK8

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-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 MAPK1 1406/4885CCNC 4349/4885CDK8 1776/4885

“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.

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