SCHEMBL1713739

SCHEMBL1713739

CN1CCN(C2=NC(=Cc3c[nH]c4ncc(-c5ccccc5)cc34)C(=O)N2)CC1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ TNIK Q9UKE5 9/20 0.46
▸ AXL P30530 3/20 0.42
▸ IL2 P60568 3/20 0.41
▸ MAP4K1 Q92918 3/20 0.41
▸ CDK8 P49336 2/20 0.41
▸ MAP3K11 Q16584 2/20 0.40
▸ GSK3B P49841 1/20 0.40
▸ SGK1 O00141 1/20 0.38

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
SCHEMBL1713737 1.00 TNIK (0.46) TNIKAXLIL2MAP4K1CDK8
SCHEMBL1714598 0.91 DYRK3 (0.44) TNIKAXLCDK8GSK3BSGK1
SCHEMBL1713732 0.91 DYRK3 (0.44) TNIKAXLCDK8GSK3BSGK1
SCHEMBL1714595 0.91 DYRK3 (0.44) TNIKAXLCDK8GSK3BSGK1
SCHEMBL1713734 0.91 DYRK3 (0.44) TNIKAXLCDK8GSK3BSGK1
SCHEMBL1713800 0.89 DYRK3 (0.46) TNIKAXLIL2MAP4K1CDK8
SCHEMBL1713805 0.89 DYRK3 (0.46) TNIKAXLIL2MAP4K1CDK8
SCHEMBL1714078 0.82 DYRK3 (0.40) MAP4K1GSK3B
SCHEMBL1714083 0.82 DYRK3 (0.40) MAP4K1GSK3B
Hydrochloric Acid SCHEMBL5089659 0.82 CHEK1 (0.46) GSK3B

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8314121-B2 Imidazolone derivatives, preparation thereof as drugs, pharmaceutical compositions, and use thereof as protein kinase inhibitors, in particular CDC7 SANOFI (FR) 2012-11-20 — — US disclosed
EP-2094699-B1 NEW IMIDAZOLONE DERIVATIVES, PREPARATION THEREOF AS DRUGS, PHARMACEUTICAL COMPOSITIONS, AND USE THEREOF AS PROTEIN KINASE INHIBITORS, IN PARTICULAR CDC7 SANOFI AVENTIS (FR) 2011-07-20 — — EP disclosed
US-20090253679-A1 NEW IMIDAZOLONE DERIVATIVES, PREPARATION THEREOF AS DRUGS, PHARMACEUTICAL COMPOSITIONS, AND USE THEREOF AS PROTEIN KINASE INHIBITORS, IN PARTICULAR CDC7 SANOFI-AVENTIS (FR) 2009-10-08 — — 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-20090253679-A1 NEW IMIDAZOLONE DERIVATIVES, PREPARATION THEREOF AS DRUGS, PHARMACEUTICAL COMPOSITIONS, AND USE THEREOF AS PROTEIN KINASE INHIBITORS, IN PARTICULAR CDC7 CDC7, CDK7, CDK17 TNIK 216/4885AXL 533/4885IL2 4014/4885

“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.

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