SCHEMBL5212652

SCHEMBL5212652

CC(C)c1nc(Nc2cccc(F)c2)ccc1C(=O)NCC1CCS(=O)(=O)C1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 12/20 0.46
IRAK4 Q9NWZ3 3/20 0.40
TNF P01375 2/20 0.38
NAMPT P43490 1/20 0.38
ALDH1A1 P00352 2/20 0.38
DGAT2 Q96PD7 1/20 0.38
KDM4E B2RXH2 1/20 0.36
GSK3B P49841 1/20 0.36
KCNH2 Q12809 1/20 0.36

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
SCHEMBL5138678 0.90 CNR2 (0.54) CNR2
SCHEMBL5214866 0.87 CNR2 (0.55) CNR2
SCHEMBL5213807 0.87 CNR2 (0.54) CNR2
SCHEMBL5217592 0.85 CNR2 (0.63) CNR2
SCHEMBL5247446 0.82 CNR2 (0.51) CNR2
SCHEMBL5214399 0.79 CNR2 (0.52) CNR2IRAK4TNFALDH1A1KDM4E
SCHEMBL14007512 0.78 CNR2 (0.73) CNR2
SCHEMBL5212877 0.78 CNR2 (0.74) CNR2
SCHEMBL5214918 0.77 CNR2 (0.69) CNR2
SCHEMBL5216303 0.76 CNR2 (0.68) CNR2ALDH1A1

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
EP-1565442-B1 PYRIDINE DERIVATIVES AS CB2 RECEPTOR MODULATORS GLAXO GROUP LTD (GB) 2007-11-14 EP claimed
EP-1565442-B1 PYRIDINE DERIVATIVES AS CB2 RECEPTOR MODULATORS GLAXO GROUP LTD (GB) 2007-11-14 EP disclosed
US-20060240048-A1 Pyridine derivatives as cb2 receptor modulators GLAXO GROUP LIMITED (GB) 2006-10-26 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-20060240048-A1 Pyridine derivatives as cb2 receptor modulators CNR2, CNR1, TRPV1 CNR2 1/4885IRAK4 1243/4885TNF 3740/4885

“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.