SCHEMBL30009836

SCHEMBL30009836

O=S(=O)(Nc1ccc(-c2ccnc3[nH]ccc23)cc1F)C1CCCCC1

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PIK3C3 Q8NEB9 1/20 0.59
JAK1 P23458 2/20 0.49
IKBKB O14920 8/20 0.49
CHUK O15111 7/20 0.49
KIT P10721 1/20 0.46
PRKCI P41743 3/20 0.45
ALOX5AP P20292 2/20 0.45
FEN1 P39748 2/20 0.45
NEK1 Q96PY6 1/20 0.45
NUDT1 P36639 1/20 0.44
CCNK O75909 1/20 0.43
CDK12 Q9NYV4 1/20 0.43
ROCK1 Q13464 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
SCHEMBL30009401 0.97 PIK3C3 (0.57) PIK3C3JAK1IKBKBCHUKKIT
SCHEMBL30010083 0.95 PIK3C3 (0.54) PIK3C3JAK1IKBKBCHUKKIT
SCHEMBL30009578 0.83 PIK3C3 (0.55) PIK3C3JAK1IKBKBCHUKPRKCI
SCHEMBL30009888 0.83 PIK3C3 (0.69) PIK3C3IKBKBCHUKNEK1ROCK1
SCHEMBL30009306 0.82 IKBKB (0.59) PIK3C3JAK1IKBKBCHUKKIT
SCHEMBL30008736 0.80 IKBKB (0.53) PIK3C3JAK1IKBKBCHUKPRKCI
SCHEMBL30008735 0.80 IKBKB (0.60) PIK3C3JAK1IKBKBCHUKKIT
SCHEMBL30009844 0.80 JAK1 (0.64) JAK1IKBKBCHUKALOX5APFEN1
SCHEMBL20917885 0.80 JAK1 (0.77) JAK1
SCHEMBL30009491 0.79 PIK3C3 (0.67) PIK3C3JAK1IKBKBCHUKNEK1

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 PIK3C3 288/4885JAK1 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.