SCHEMBL30009857

SCHEMBL30009857

CCS(=O)(=O)Nc1ccc(-c2ccnc3[nH]ccc23)c(C)c1C

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK1 P23458 3/20 0.57
IKBKB O14920 6/20 0.48
CHUK O15111 5/20 0.48
CIT O14578 4/20 0.44
CCNK O75909 2/20 0.43
CDK12 Q9NYV4 2/20 0.43
NEK1 Q96PY6 5/20 0.43
NUDT1 P36639 1/20 0.42
DAPK3 O43293 1/20 0.42
JAK2 O60674 1/20 0.42
PRKD3 O94806 1/20 0.42
MAP4K4 O95819 1/20 0.42
PAK4 O96013 1/20 0.42
CSF1R P07333 1/20 0.42
RET P07949 1/20 0.42
IGF1R P08069 1/20 0.42
FGFR1 P11362 1/20 0.42
PRKACA P17612 1/20 0.42
FLT1 P17948 1/20 0.42
LTK P29376 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
SCHEMBL30008717 0.93 JAK1 (0.58) JAK1IKBKBCHUKCITCCNK
SCHEMBL30009164 0.90 JAK1 (0.59) JAK1IKBKBCHUKCITCCNK
SCHEMBL30009511 0.81 CIT (0.59) JAK1IKBKBCHUKCITCCNK
SCHEMBL12605437 0.80 TNNI3K (0.48) JAK1IKBKBCHUKCITCCNK
SCHEMBL30008811 0.80 CIT (0.60) JAK1IKBKBCHUKCIT
SCHEMBL30009803 0.79 IKBKB (0.55) JAK1IKBKBCHUKCITCCNK
SCHEMBL30009181 0.79 CIT (0.50) JAK1IKBKBCHUKCITCCNK
SCHEMBL30009844 0.78 JAK1 (0.64) JAK1IKBKBCHUKCITCCNK
SCHEMBL30009421 0.78 JAK1 (0.46) JAK1IKBKBCHUKCITCCNK
SCHEMBL30008778 0.77 CIT (0.61) JAK1IKBKBCHUKCIT

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.