SCHEMBL30008944

SCHEMBL30008944

CCCCNC(=O)Nc1ccc(-c2ccnc3[nH]ccc23)cc1

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
JAK1 P23458 1/20 0.62
KIT P10721 3/20 0.60
PDGFRA P16234 3/20 0.60
CIT O14578 14/20 0.60
KDR P35968 1/20 0.56
NEK1 Q96PY6 1/20 0.56
AURKA O14965 1/20 0.56
LYN P07948 1/20 0.56
IGF1R P08069 1/20 0.56
MET P08581 1/20 0.56
ROCK1 Q13464 1/20 0.56
AURKB Q96GD4 1/20 0.56
INCENP Q9NQS7 1/20 0.56

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
SCHEMBL30009459 0.89 CIT (0.64) JAK1CITAURKAAURKB
SCHEMBL30009316 0.87 JAK1 (0.54) JAK1CITNEK1
SCHEMBL30009617 0.82 JAK1 (0.63) JAK1KITPDGFRACITKDR
SCHEMBL30009201 0.81 JAK1 (0.62) JAK1CITNEK1AURKAAURKB
SCHEMBL4794287 0.80 CIT (0.66) KITCITKDRAURKALYN
SCHEMBL4794268 0.80 AURKB (0.73) CITKDRAURKALYNIGF1R
SCHEMBL1718374 0.80 CIT (0.71) CIT
SCHEMBL28891155 0.79 KIT (0.74) KITPDGFRAKDR
SCHEMBL4791969 0.79 CIT (0.63) CITAURKAAURKB
SCHEMBL30009371 0.79 CIT (0.63) CITAURKAAURKB

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 83/4885KIT 3668/4885PDGFRA 2337/4885

“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.