SCHEMBL2791632

SCHEMBL2791632

NC(CNC(=O)NCc1ccccc1)c1ccc(C(=O)Nc2ccncc2)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 13/20 0.63
▸ ROCK2 O75116 4/20 0.56
▸ ROCK1 Q13464 4/20 0.56
▸ HTT P42858 1/20 0.52
▸ JAK2 O60674 1/20 0.51
▸ TYK2 P29597 1/20 0.51
▸ RPS6KA5 O75582 1/20 0.50
▸ MAP4K4 O95819 1/20 0.50
▸ PRKCG P05129 1/20 0.50
▸ PRKACA P17612 1/20 0.50
▸ RPS6KB1 P23443 1/20 0.50
▸ MAPK1 P28482 1/20 0.50
▸ AKT1 P31749 1/20 0.50
▸ GSK3A P49840 1/20 0.50
▸ GSK3B P49841 1/20 0.50
▸ PRKX P51817 1/20 0.50
▸ PRKCD Q05655 1/20 0.50
▸ PRKG2 Q13237 1/20 0.50
▸ DYRK1A Q13627 1/20 0.50
▸ PRKG1 Q13976 1/20 0.50

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
SCHEMBL2791408 0.89 NAMPT (0.65) NAMPTROCK2ROCK1
SCHEMBL2793965 0.87 NAMPT (0.67) NAMPTROCK2ROCK1
SCHEMBL2794381 0.86 ROCK2 (0.64) NAMPTROCK2ROCK1HTTJAK2
SCHEMBL2793411 0.86 ROCK2 (0.57) NAMPTROCK2ROCK1HTTJAK2
SCHEMBL2794930 0.86 NAMPT (0.58) NAMPTROCK2ROCK1HTTJAK2
SCHEMBL2795287 0.85 NAMPT (0.59) NAMPTROCK2ROCK1JAK2TYK2
SCHEMBL2795774 0.85 POLB (0.63) NAMPTROCK2ROCK1HTTJAK2
SCHEMBL2792854 0.83 ROCK2 (0.60) NAMPTROCK2ROCK1HTTJAK2
SCHEMBL3502319 0.83 NAMPT (0.60) NAMPTROCK2ROCK1HTTJAK2
SCHEMBL3502315 0.83 NAMPT (0.60) NAMPTROCK2ROCK1HTTJAK2

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-20100168102-A9 Amide Derivatives as Kinase Inhibitors DEVGEN NV (BE) 2010-07-01 — — US disclosed
US-20090118283-A1 Amide Derivatives as Kinase Inhibitors DEVGEN NV (BE) 2009-05-07 — — 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 (2 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-20100168102-A9 Amide Derivatives as Kinase Inhibitors MAP3K1, CDK1, CDK2 NAMPT 1420/4885ROCK2 528/4885ROCK1 414/4885
US-20090118283-A1 Amide Derivatives as Kinase Inhibitors MAP3K1, CDK1, CDK2 NAMPT 1420/4885ROCK2 528/4885ROCK1 414/4885

“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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