SCHEMBL386227

SCHEMBL386227

CCC(C)OC(=O)N1CCC(Cc2noc(-c3cc4c(C#N)nccc4o3)n2)CC1

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 1/20 0.33
FAAH O00519 1/20 0.33
CETP P11597 1/20 0.33
IRAK4 Q9NWZ3 7/20 0.33
MGLL Q99685 1/20 0.33
HRH3 Q9Y5N1 1/20 0.32
KCNH2 Q12809 1/20 0.32
GPR119 Q8TDV5 5/20 0.31
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
CHRM5 P08912 1/20 0.31
CHRM1 P11229 1/20 0.31
CHRM3 P20309 1/20 0.31
GRM4 Q14833 1/20 0.31

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
SCHEMBL390737 1.00 GRIN2B (0.33) GRIN2BFAAHCETPIRAK4MGLL
SCHEMBL386226 1.00 GRIN2B (0.33) GRIN2BFAAHCETPIRAK4MGLL
SCHEMBL389923 0.93 FAAH (0.39) GRIN2BFAAHCETPIRAK4GPR119
SCHEMBL388785 0.93 IRAK4 (0.33) GRIN2BFAAHCETPIRAK4HRH3
SCHEMBL387415 0.92 JAK1 (0.35) GRIN2BFAAHCETPIRAK4MGLL
SCHEMBL388767 0.90 KCNH2 (0.40) GRIN2BCETPKCNH2CHRM4
SCHEMBL391645 0.89 TLR9 (0.35) GRIN2BIRAK4KCNH2GPR119
SCHEMBL391443 0.88 SMYD3 (0.35) GRIN2BCETPKCNH2GPR119
SCHEMBL390095 0.87 GPR119 (0.45) FAAHCETPGPR119
SCHEMBL391559 0.87 JAK1 (0.35) GRIN2BMGLLKCNH2GPR119CHRM2

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
US-8193359-B2 G-protein coupled receptor agonists PROSIDION LIMITED (GB) 2012-06-05 US disclosed
US-8193359-B2 G-protein coupled receptor agonists PROSIDION LIMITED (GB) 2012-06-05 US disclosed
US-8101626-B2 GPR119 receptor agonists in methods of increasing bone mass and of treating osteoporosis and other conditions characterized by low bone mass, and combination therapy relating thereto ARENA PHARMACEUTICALS, INC. (US) 2012-01-24 US disclosed
EP-2004157-B1 USE OF GPR119 RECEPTOR AGONISTS FOR INCREASING BONE MASS AND FOR TREATING OSTEOPOROSIS, AS WELL AS COMBINATION THERAPY RELATING THERETO ARENA PHARM INC (US) 2011-01-12 EP disclosed
US-20090099227-A1 G-Protein Coupled Receptor Agonists PROSIDION LIMITED (GB) 2009-04-16 US disclosed
US-20090099227-A1 G-Protein Coupled Receptor Agonists PROSIDION LIMITED (GB) 2009-04-16 US 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-20090099227-A1 G-Protein Coupled Receptor Agonists GPR119, GPR65, GPR84 GRIN2B 688/4885FAAH 559/4885CETP 886/4885

“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.