SCHEMBL30009522

SCHEMBL30009522

C=CCS(=O)(=O)NC1CC=C(c2ccnc3[nH]ccc23)CC1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
JAK1 P23458 9/20 0.50
PIK3C3 Q8NEB9 1/20 0.43
IKBKB O14920 5/20 0.41
CHUK O15111 5/20 0.41
CCNT1 O60563 2/20 0.38
CDK9 P50750 2/20 0.38
CIT O14578 1/20 0.37
NEK1 Q96PY6 2/20 0.37

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
SCHEMBL30009362 0.88 JAK1 (0.63) JAK1PIK3C3IKBKBCHUKCCNT1
SCHEMBL30009346 0.85 JAK1 (0.65) JAK1PIK3C3IKBKBCHUKCCNT1
SCHEMBL30009242 0.81 JAK1 (0.58) JAK1PIK3C3IKBKBCHUKCCNT1
SCHEMBL20930648 0.79 JAK1 (0.81) JAK1
SCHEMBL30009178 0.74 JAK1 (0.53) JAK1PIK3C3CCNT1CDK9CIT
SCHEMBL30009838 0.72 JAK1 (0.67) JAK1CCNT1CDK9
SCHEMBL30008940 0.70 IKBKB (0.66) PIK3C3IKBKBCHUKCDK9CIT
SCHEMBL20930187 0.67 JAK1 (1.00) JAK1
SCHEMBL30009536 0.67 JAK2 (0.56) JAK1
SCHEMBL20930517 0.66 JAK1 (0.84) JAK1

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 83/4885PIK3C3 288/4885IKBKB 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.