SCHEMBL30009237

SCHEMBL30009237

N#CCC(=O)N1CC=C(c2ccnc3[nH]ccc23)C1

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
JAK1 P23458 13/20 0.52
CCNT1 O60563 2/20 0.47
CDK9 P50750 2/20 0.47
JAK3 P52333 10/20 0.46
JAK2 O60674 8/20 0.46
TYK2 P29597 2/20 0.44
KCNH2 Q12809 1/20 0.44

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
SCHEMBL14493885 0.89 JAK1 (0.57) JAK1CCNT1CDK9JAK3JAK2
SCHEMBL12696510 0.87 JAK1 (0.49) JAK1CCNT1CDK9JAK3JAK2
SCHEMBL12613120 0.81 JAK1 (0.47) JAK1JAK3JAK2TYK2
SCHEMBL12612582 0.81 JAK1 (0.47) JAK1JAK3JAK2TYK2
SCHEMBL30009431 0.81 JAK1 (0.55) JAK1JAK3JAK2TYK2
SCHEMBL29931152 0.81 JAK1 (0.67) JAK1JAK3JAK2TYK2
SCHEMBL12613663 0.80 JAK1 (0.48) JAK1JAK3JAK2TYK2
SCHEMBL30009330 0.79 JAK1 (0.51) JAK1JAK3JAK2
SCHEMBL20919095 0.78 JAK1 (0.84) JAK1
SCHEMBL12612169 0.78 JAK1 (0.56) JAK1JAK3JAK2TYK2

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 83/4885CCNT1 2852/4885CDK9 330/4885

“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.