SCHEMBL30009873

SCHEMBL30009873

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

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
JAK1 P23458 5/20 0.60
CIT O14578 10/20 0.58
IKBKB O14920 2/20 0.51
CHUK O15111 2/20 0.51
KIT P10721 1/20 0.45
CYP17A1 P05093 1/20 0.43
BRD4 O60885 1/20 0.43

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
SCHEMBL30008811 0.93 CIT (0.60) JAK1CITIKBKBCHUK
SCHEMBL30008979 0.89 CIT (0.59) JAK1CITIKBKBCHUKKIT
SCHEMBL30009384 0.85 JAK1 (0.62) JAK1CITIKBKBCHUKBRD4
SCHEMBL30010048 0.83 IKBKB (0.73) CITIKBKBCHUK
SCHEMBL30009497 0.82 JAK1 (0.61) JAK1CITIKBKBCHUKKIT
SCHEMBL30008778 0.81 CIT (0.61) JAK1CITIKBKBCHUK
SCHEMBL30009322 0.81 JAK1 (0.63) JAK1CITIKBKBCHUKCYP17A1
SCHEMBL30008938 0.81 CIT (0.60) JAK1CITIKBKBCHUKKIT
SCHEMBL30008717 0.81 JAK1 (0.58) JAK1CITIKBKBCHUK
SCHEMBL30009389 0.79 JAK1 (0.65) JAK1CITIKBKBCHUKCYP17A1

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 83/4885CIT 417/4885IKBKB 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.