SCHEMBL2746892

SCHEMBL2746892

CC(C)(N)C(=O)Nc1ccc(C(N)=O)cn1

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NNMT P40261 4/20 0.61
EPHX2 P34913 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.46
DEGS1 O15121 1/20 0.44
HCAR3 P49019 2/20 0.42

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
SCHEMBL5537643 0.89 NNMT (0.63) NNMTEPHX2SMN1; SMN2DEGS1
SCHEMBL17409818 0.81 RAB9A (0.64) SMN1; SMN2
SCHEMBL3465475 0.80 NNMT (0.69) NNMTEPHX2SMN1; SMN2HCAR3
SCHEMBL5734042 0.79 NNMT (0.58) NNMTEPHX2SMN1; SMN2
SCHEMBL14185002 0.79 NNMT (0.67) NNMTEPHX2SMN1; SMN2HCAR3
SCHEMBL2746891 0.78 NNMT (0.61) NNMTEPHX2SMN1; SMN2HCAR3
SCHEMBL28157252 0.78 NNMT (0.70) NNMTEPHX2SMN1; SMN2HCAR3
SCHEMBL17409782 0.77 DEGS1 (0.49) EPHX2SMN1; SMN2DEGS1
SCHEMBL6700940 0.77 NNMT (0.59) NNMTEPHX2SMN1; SMN2HCAR3
SCHEMBL855055 0.77 NNMT (0.47) NNMTEPHX2SMN1; SMN2DEGS1HCAR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8367666-B2 3-carbamoyl-2-pyridone derivatives SHIONOGI & CO., LTD. (JP) 2013-02-05 US disclosed
US-20120208813-A1 3-CARBAMOYL-2-PYRIDONE DERIVATIVES SHIONOGI & CO., LTD. 2012-08-16 US disclosed
US-8178681-B2 methyl 3-methyl-2-{[2-oxo-1-(2-oxo-ethyl)-1,2,5,6,7,8,9,10-octahydro-cycloocta[b]pyridine-3-carbonyl]-amino}-butyrate; cannabinoid receptor agonist; antiinflammatory agent, immunostimulant, analgesic; atopic dermatitis; excellent in photostability, and have excellent transdermal and oral absorbency SHIONOGI & CO., LTD. (JP) 2012-05-15 US disclosed
US-20080103139-A1 3-Carbamoyl-2-Pyridone Derivative SHIONOGI & CO. LTD. (JP) 2008-05-01 US disclosed
EP-1806342-A1 3-CARBAMOYL-2-PYRIDONE DERIVATIVE SHIONOGI & CO., LTD. (JP) 2007-07-11 EP 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-20120208813-A1 3-CARBAMOYL-2-PYRIDONE DERIVATIVES CNR2, CNR1, HRH4 NNMT 2607/4885EPHX2 1166/4885SMN1; SMN2 4550/4885
US-20080103139-A1 3-Carbamoyl-2-Pyridone Derivative CNR1, CNR2, HRH4 NNMT 2706/4885EPHX2 1521/4885SMN1; SMN2 4482/4885

“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.