SCHEMBL30008766

SCHEMBL30008766

O=C(c1ccncc1)N1CCC(Nc2ccc(-c3ccnc4[nH]ccc34)cc2)CC1

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
JAK1 P23458 4/20 0.50
IKBKB O14920 3/20 0.50
CHUK O15111 3/20 0.50
CIT O14578 10/20 0.48
NEK1 Q96PY6 1/20 0.46
PIK3C3 Q8NEB9 1/20 0.45

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
SCHEMBL30356041 0.82 JAK1 (0.71) JAK1
SCHEMBL20918698 0.82 JAK1 (0.71) JAK1
SCHEMBL857035 0.81 IKBKB (0.64) JAK1IKBKBCHUKCITNEK1
SCHEMBL857458 0.80 IKBKB (0.63) IKBKBCHUKCITNEK1PIK3C3
SCHEMBL30009173 0.78 JAK1 (0.61) JAK1IKBKBCHUKCITNEK1
SCHEMBL4873430 0.78 IKBKB (0.60) JAK1IKBKBCHUKCITNEK1
SCHEMBL20918151 0.75 JAK1 (0.71) JAK1
SCHEMBL30009302 0.72 JAK1 (0.52) JAK1IKBKBCHUK
SCHEMBL10124954 0.72 NEK1 (0.68) IKBKBCHUKCITNEK1PIK3C3
SCHEMBL20930352 0.71 JAK1 (0.72) JAK1

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-11524968-B2 Heterocyclic compound as a protein kinase inhibitor HK INNO.N CORPORATION (KR) 2022-12-13 US claimed

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 83/4885IKBKB 294/4885CHUK 53/4885

“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.