SCHEMBL2746436

SCHEMBL2746436

CC(=O)Oc1ccc(NC(=O)c2cc3c(n(Cc4ccc(F)cc4)c2=O)CCCCCC3)cc1

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 16/20 0.58
CNR1 P21554 15/20 0.58
HPGD P15428 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
MEN1 O00255 1/20 0.49
ALDH1A1 P00352 1/20 0.49
KMT2A Q03164 1/20 0.49
FAAH O00519 4/20 0.44
ABHD6 Q9BV23 1/20 0.44
LMNA P02545 2/20 0.42
MAPT P10636 1/20 0.42
ABHD12 Q8N2K0 1/20 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
SCHEMBL2747805 0.92 CNR2 (0.52) CNR2CNR1LMNAMAPT
SCHEMBL2746610 0.92 CNR2 (0.52) CNR2CNR1SMN1; SMN2KMT2ALMNA
SCHEMBL2746061 0.90 CNR1 (0.51) CNR2CNR1
SCHEMBL2746668 0.89 CNR1 (0.60) CNR2CNR1SMN1; SMN2MEN1KMT2A
SCHEMBL2746434 0.85 CNR1 (0.58) CNR2CNR1HPGDSMN1; SMN2L3MBTL1
SCHEMBL2746508 0.84 CNR2 (0.60) CNR2CNR1HPGDALDH1A1MAPT
SCHEMBL2746601 0.84 CNR2 (0.52) CNR2CNR1ALDH1A1
SCHEMBL2745557 0.83 CNR2 (0.66) CNR2CNR1HPGDALDH1A1LMNA
SCHEMBL2745604 0.83 CNR2 (0.66) CNR2CNR1HPGDALDH1A1LMNA
SCHEMBL2746576 0.83 MAPT (0.50) CNR2CNR1HPGDMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1806342-B1 3-CARBAMOYL-2-PYRIDONE DERIVATIVE SHIONOGI & CO (JP) 2013-04-17 EP disclosed
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 CNR2 1/4885CNR1 2/4885HPGD 1235/4885
US-20080103139-A1 3-Carbamoyl-2-Pyridone Derivative CNR1, CNR2, HRH4 CNR2 2/4885CNR1 1/4885HPGD 1169/4885

“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.