SCHEMBL31696458

SCHEMBL31696458

CC(C)(C)OC(=O)N[C@H]1CCn2nc(Br)cc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.39
NFKB1 P19838 1/20 0.37
NFKB2 Q00653 1/20 0.37
RELA Q04206 1/20 0.37
CTSK P43235 2/20 0.37
SUV39H2 Q9H5I1 1/20 0.36
CKS1B P61024 1/20 0.35
SKP1 P63208 1/20 0.35
SKP2 Q13309 1/20 0.35
KDM4D Q6B0I6 2/20 0.35
CFTR P13569 2/20 0.35
BACE1 P56817 1/20 0.35
EPHX2 P34913 1/20 0.35
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
DRD2 P14416 2/20 0.34
KMT2A Q03164 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
NAMPT P43490 1/20 0.34
BTK Q06187 1/20 0.34

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
SCHEMBL18366662 0.82 RIPK1 (0.42) GAA
SCHEMBL22887611 0.75 DRD2 (0.35) NFKB1NFKB2RELACTSKSUV39H2
SCHEMBL31696419 0.73 GPR119 (0.35) CKS1BSKP1SKP2KDM4D
SCHEMBL31696434 0.71
SCHEMBL30892162 0.71 GAA (0.42) GAANFKB1NFKB2RELACTSK
SCHEMBL31696397 0.71
SCHEMBL26026951 0.71 GRM5 (0.36) KMT2A
SCHEMBL31696554 0.71 RIPK1 (0.35)
SCHEMBL18366657 0.70 RIPK1 (0.42) GAA
SCHEMBL30926332 0.69 GAA (0.36) GAANFKB1NFKB2RELAKDM4D

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-12630533-B2 Heterocyclic compounds useful as KCNT1 inhibitors ACTIO BIOSCIENCES, INC. (US) 2026-05-19 US disclosed
US-20250313548-A1 HETEROCYCLIC COMPOUNDS USEFUL AS KCNT1 INHIBITORS ACTIO BIOSCIENCES, INC. 2025-10-09 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 (2 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-20250313548-A1 HETEROCYCLIC COMPOUNDS USEFUL AS KCNT1 INHIBITORS KCNT1, KCNT2, KCNN3 GAA 941/4885NFKB1 3463/4885NFKB2 3140/4885
US-12630533-B2 Heterocyclic compounds useful as KCNT1 inhibitors KCNT1, KCNT2, KCNJ2 GAA 3225/4885NFKB1 3765/4885NFKB2 2943/4885

“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.