SCHEMBL2746360

SCHEMBL2746360

COc1ccc(Cn2c(C)c(C)cc(C(=O)Nc3ccccc3OC(C)=O)c2=O)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.46
FAAH O00519 1/20 0.45
CNR1 P21554 1/20 0.45
CNR2 P34972 1/20 0.45
ABHD6 Q9BV23 1/20 0.45
HDAC1 Q13547 1/20 0.44
ALDH1A1 P00352 2/20 0.44
POLB P06746 1/20 0.43
KDM4E B2RXH2 2/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 1/20 0.42
P2RX7 Q99572 2/20 0.42
MAPK1 P28482 1/20 0.41
PTGER3 P43115 1/20 0.41
RECQL P46063 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
PDE10A Q9Y233 1/20 0.41
AHR P35869 1/20 0.41
KLK1 P06870 1/20 0.41

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
SCHEMBL2746133 0.91 MAPT (0.46) MAPTFAAHCNR1CNR2ALDH1A1
SCHEMBL2746179 0.91 CNR2 (0.47) MAPTFAAHCNR1CNR2ABHD6
SCHEMBL2746730 0.88 MAPT (0.40) MAPTFAAHCNR1CNR2ALDH1A1
SCHEMBL2746803 0.87 MAPT (0.49) MAPTCNR1CNR2ALDH1A1POLB
SCHEMBL2746195 0.85 MAPT (0.49) MAPTCNR2ALDH1A1POLBPTGER3
SCHEMBL2746366 0.84 AHR (0.48) MAPTFAAHCNR1CNR2ABHD6
SCHEMBL2746373 0.81 CNR2 (0.62) MAPTCNR1CNR2ALDH1A1KMT2A
SCHEMBL2746135 0.77 KMT2A (0.45) MAPTALDH1A1POLBKMT2ANPC1
SCHEMBL2747803 0.77 CNR2 (0.51) MAPTCNR1CNR2
SCHEMBL2746607 0.75 CNR1 (0.51) MAPTCNR1CNR2KMT2ANPC1

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 MAPT 2374/4885FAAH 113/4885CNR1 2/4885
US-20080103139-A1 3-Carbamoyl-2-Pyridone Derivative CNR1, CNR2, HRH4 MAPT 4270/4885FAAH 146/4885CNR1 1/4885

“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.