SCHEMBL30009468

SCHEMBL30009468

O=C(Cc1ccc(-c2ccnc3[nH]ccc23)cc1)N1CCOCC1

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
JAK1 P23458 11/20 0.63
NEK1 Q96PY6 2/20 0.55
AURKA O14965 1/20 0.54
AURKB Q96GD4 1/20 0.54
MAPT P10636 1/20 0.53
IKBKB O14920 2/20 0.51
CHUK O15111 2/20 0.51
PRKAB2 O43741 1/20 0.50
PRKAG1 P54619 1/20 0.50
PRKAA2 P54646 1/20 0.50
PRKAA1 Q13131 1/20 0.50
PRKAG3 Q9UGI9 1/20 0.50
PRKAG2 Q9UGJ0 1/20 0.50
PRKAB1 Q9Y478 1/20 0.50

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
SCHEMBL30009139 0.90 JAK1 (0.61) JAK1NEK1AURKBIKBKBCHUK
SCHEMBL30009807 0.90 JAK1 (0.61) JAK1NEK1AURKBIKBKBCHUK
SCHEMBL30009063 0.89 ROCK2 (0.54) JAK1NEK1AURKBIKBKBCHUK
SCHEMBL30008722 0.89 JAK1 (0.62) JAK1NEK1AURKBIKBKBCHUK
SCHEMBL30009811 0.87 JAK1 (0.63) JAK1NEK1IKBKBCHUK
SCHEMBL30008764 0.87 JAK1 (0.63) JAK1NEK1IKBKBCHUK
SCHEMBL30009207 0.87 JAK1 (0.53) JAK1NEK1IKBKBCHUK
SCHEMBL30009818 0.85 JAK1 (0.52) JAK1NEK1IKBKBCHUK
SCHEMBL4873430 0.83 IKBKB (0.60) JAK1NEK1AURKAAURKBIKBKB
SCHEMBL30009454 0.83 JAK1 (0.68) JAK1IKBKBCHUK

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-11524968-B2 Heterocyclic compound as a protein kinase inhibitor HK INNO.N CORPORATION (KR) 2022-12-13 US claimed
US-11524968-B2 Heterocyclic compound as a protein kinase inhibitor HK INNO.N CORPORATION (KR) 2022-12-13 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-11524968-B2 Heterocyclic compound as a protein kinase inhibitor MAP3K20, MAP3K15, MAP3K1 JAK1 83/4885NEK1 178/4885AURKA 422/4885

“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.