SCHEMBL2746870

SCHEMBL2746870

CCc1c(C)cc(C(=O)Nc2ccc(OC(C)=O)cc2)c(=O)n1CC1CCCCC1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 12/20 0.49
CNR1 P21554 11/20 0.49
LDLR P01130 2/20 0.45
KMT2A Q03164 2/20 0.40
KDM4E B2RXH2 2/20 0.39
HPGD P15428 1/20 0.39
POLB P06746 1/20 0.38
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
TP53 P04637 1/20 0.38

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
SCHEMBL2746565 0.89 CNR2 (0.49) CNR2CNR1LDLRKMT2AKDM4E
SCHEMBL2746869 0.84 CNR2 (0.51) CNR2CNR1
SCHEMBL11908503 0.83 CNR2 (0.43) CNR2CNR1KMT2AMEN1
SCHEMBL11908504 0.83 LDLR (0.35) CNR2CNR1LDLRKDM4EHPGD
SCHEMBL11908500 0.82 CNR2 (0.47) CNR2CNR1POLBALDH1A1MAPT
SCHEMBL2746903 0.82 CNR2 (0.57) CNR2CNR1KMT2AKDM4EHPGD
SCHEMBL2747841 0.81 CNR2 (0.73) CNR2CNR1
SCHEMBL2746139 0.81 CNR2 (0.73) CNR2CNR1
SCHEMBL5512992 0.80 CNR2 (0.52) CNR2CNR1
SCHEMBL5515815 0.80 BRD4 (0.51) CNR2CNR1

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 4 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-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 CNR2 2/4885CNR1 1/4885LDLR 1844/4885

“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.