SCHEMBL30419282

SCHEMBL30419282

Cc1cnn(-c2ccnc(Cl)c2NC(=O)OC(C)(C)C)c1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ATR Q13535 1/20 0.55
CYP46A1 Q9Y6A2 2/20 0.37
SCD O00767 1/20 0.37
GSK3B P49841 1/20 0.36
DYRK1A Q13627 1/20 0.36
LCK P06239 3/20 0.36
RORC P51449 1/20 0.35
CYP17A1 P05093 1/20 0.34
MAPKAPK2 P49137 1/20 0.34
HDAC3 O15379 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
NCOR2 Q9Y618 1/20 0.34
AAK1 Q2M2I8 1/20 0.33
POLB P06746 1/20 0.33
NTRK1 P04629 1/20 0.33
P2RX7 Q99572 1/20 0.33
NAMPT P43490 1/20 0.33

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
SCHEMBL26152071 0.88 ATR (0.54) ATRSCDGSK3BDYRK1ARORC
SCHEMBL25174097 0.85 CYP46A1 (0.39) ATRCYP46A1POLBNTRK1
SCHEMBL30418901 0.78 CYP46A1 (0.37) ATRCYP46A1SCDGSK3BDYRK1A
SCHEMBL1699175 0.77 ATR (0.69) ATRLCKCYP17A1MAPKAPK2AAK1
SCHEMBL30418941 0.73 ATR (0.67) ATRLCKCYP17A1MAPKAPK2AAK1
SCHEMBL1253908 0.73 ATR (0.67) ATRLCKCYP17A1MAPKAPK2AAK1
SCHEMBL2755109 0.72 ATR (0.66) ATRLCKCYP17A1MAPKAPK2AAK1
SCHEMBL29847807 0.72 ATR (0.78) ATRLCKCYP17A1MAPKAPK2POLB
SCHEMBL22716184 0.72 ATR (0.78) ATRLCKCYP17A1MAPKAPK2AAK1
SCHEMBL29439835 0.72 ATR (0.78) ATRLCKCYP17A1MAPKAPK2AAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250129044-A1 PYRIDINYL DERIVATIVES AS SODIUM CHANNEL ACTIVATORS XENON PHARMACEUTICALS INC. (CA) 2025-04-24 US disclosed
EP-4405344-A2 PYRIDINYL DERIVATIVES AS SODIUM CHANNEL ACTIVATORS Xenon Pharmaceuticals Inc. (CA) 2024-07-31 EP disclosed
US-20230150972-A1 PYRIDINYL DERIVATIVES AS SODIUM CHANNEL ACTIVATORS XENON PHARMACEUTICALS INC. (CA) 2023-05-18 US disclosed
WO-2023049369-A2 PYRIDINYL DERIVATIVES AS SODIUM CHANNEL ACTIVATORS XENON PHARMACEUTICALS INC. (CA) 2023-03-30 WO 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-20250129044-A1 PYRIDINYL DERIVATIVES AS SODIUM CHANNEL ACTIVATORS SCN1B, SCN1A, SCN2B ATR 4311/4885CYP46A1 3841/4885SCD 2929/4885
US-20230150972-A1 PYRIDINYL DERIVATIVES AS SODIUM CHANNEL ACTIVATORS SCN1B, SCN1A, SCN2B ATR 4311/4885CYP46A1 3841/4885SCD 2929/4885

“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.