SCHEMBL30009350

SCHEMBL30009350

O=S(=O)(Nc1ccc(-c2ccnc3[nH]ccc23)cc1F)N1CCOCC1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NEK1 Q96PY6 2/20 0.53
ALOX5AP P20292 3/20 0.50
FEN1 P39748 3/20 0.50
IKBKB O14920 5/20 0.49
CHUK O15111 5/20 0.49
PIK3CA P42336 2/20 0.46
PRKCI P41743 2/20 0.44
ATR Q13535 4/20 0.43
RPS6KA3 P51812 1/20 0.43
PDCD1 Q15116 3/20 0.42
CD274 Q9NZQ7 3/20 0.42
MTOR P42345 2/20 0.42
CHEK1 O14757 2/20 0.42
ATRIP Q8WXE1 2/20 0.42
PIK3C3 Q8NEB9 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
SCHEMBL30008735 0.91 IKBKB (0.60) NEK1ALOX5APFEN1IKBKBCHUK
SCHEMBL30009306 0.90 IKBKB (0.59) NEK1ALOX5APFEN1IKBKBCHUK
SCHEMBL30009314 0.83 IKBKB (0.62) NEK1IKBKBCHUKRPS6KA3PIK3C3
SCHEMBL30010083 0.81 PIK3C3 (0.54) ALOX5APFEN1IKBKBCHUKPRKCI
SCHEMBL20918196 0.79 JAK1 (0.66)
SCHEMBL30355802 0.79 JAK1 (0.66)
SCHEMBL30009844 0.78 JAK1 (0.64) NEK1ALOX5APFEN1IKBKBCHUK
SCHEMBL30009401 0.77 PIK3C3 (0.57) NEK1ALOX5APFEN1IKBKBCHUK
SCHEMBL30009359 0.76 JAK1 (0.56) NEK1ALOX5APFEN1IKBKBCHUK
SCHEMBL30009836 0.76 PIK3C3 (0.59) NEK1ALOX5APFEN1IKBKBCHUK

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 NEK1 178/4885ALOX5AP 3720/4885FEN1 4625/4885

“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.