SCHEMBL30008979

SCHEMBL30008979

CCCS(=O)(=O)Nc1ccc(-c2ccnc3[nH]ccc23)c(CC)c1

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CIT O14578 10/20 0.59
JAK1 P23458 5/20 0.53
IKBKB O14920 2/20 0.51
CHUK O15111 2/20 0.51
BRD4 O60885 1/20 0.43
KIT P10721 1/20 0.43
CYP3A4 P08684 1/20 0.42
ROCK1 Q13464 1/20 0.42

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
SCHEMBL30009497 0.93 JAK1 (0.61) CITJAK1IKBKBCHUKBRD4
SCHEMBL30008778 0.93 CIT (0.61) CITJAK1IKBKBCHUK
SCHEMBL30009873 0.89 JAK1 (0.60) CITJAK1IKBKBCHUKBRD4
SCHEMBL30009619 0.87 CIT (0.56) CITJAK1IKBKBCHUK
SCHEMBL30009384 0.85 JAK1 (0.62) CITJAK1IKBKBCHUKBRD4
SCHEMBL30009209 0.84 JAK1 (0.59) CITJAK1IKBKBCHUKROCK1
SCHEMBL30010048 0.83 IKBKB (0.73) CITIKBKBCHUKROCK1
SCHEMBL30009495 0.82 JAK1 (0.62) CITJAK1IKBKBCHUKBRD4
SCHEMBL30008811 0.81 CIT (0.60) CITJAK1IKBKBCHUK
SCHEMBL30008938 0.81 CIT (0.60) CITJAK1IKBKBCHUKKIT

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 CIT 417/4885JAK1 83/4885IKBKB 294/4885

“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.