SCHEMBL2746572

SCHEMBL2746572

CC(=O)Oc1ccccc1NC(=O)c1cc2c(n(Cc3ccco3)c1=O)CCCCCC2

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 12/20 0.49
CNR2 P34972 12/20 0.49
MAPT P10636 4/20 0.46
MEN1 O00255 1/20 0.42
HPGD P15428 1/20 0.42
KMT2A Q03164 1/20 0.42
THRB P10828 1/20 0.41
TP53 P04637 1/20 0.41
KDM4E B2RXH2 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40

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
SCHEMBL11907068 0.93 CNR1 (0.46) CNR1CNR2MAPTMEN1HPGD
SCHEMBL11907069 0.87 MEN1 (0.44) CNR1CNR2MAPTMEN1HPGD
SCHEMBL2746576 0.86 MAPT (0.50) CNR1CNR2MAPTMEN1HPGD
SCHEMBL2746607 0.85 CNR1 (0.51) CNR1CNR2MAPTKMT2ATP53
SCHEMBL2747803 0.85 CNR2 (0.51) CNR1CNR2MAPT
SCHEMBL2746434 0.85 CNR1 (0.58) CNR1CNR2MEN1HPGDKMT2A
SCHEMBL2746504 0.83 CNR2 (0.65) CNR1CNR2
SCHEMBL2746598 0.83 CNR2 (0.53) CNR1CNR2
SCHEMBL2745555 0.82 CNR2 (0.64) CNR1CNR2
SCHEMBL2745601 0.82 CNR2 (0.64) CNR1CNR2

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-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 (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-20080103139-A1 3-Carbamoyl-2-Pyridone Derivative CNR1, CNR2, HRH4 CNR1 1/4885CNR2 2/4885MAPT 4270/4885

“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.