SCHEMBL4650342

SCHEMBL4650342

CC(C)CNCc1cnc(Nc2ccc(Cl)c(Cl)c2)cc1C(C)C

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 9/20 0.45
KMO O15229 1/20 0.38
CHRNB4 P30926 1/20 0.35
CHRNA3 P32297 1/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
KMT2A Q03164 1/20 0.35
POLA1 P09884 1/20 0.35
IDO1 P14902 1/20 0.34
BCL6 P41182 1/20 0.34
NCOR2 Q9Y618 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
DHFR P00374 1/20 0.34
KDR P35968 1/20 0.33
POLB P06746 1/20 0.33

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
SCHEMBL4649776 0.83 CNR2 (0.50) CNR2KMOCHRNB4CHRNA3KDR
SCHEMBL4649764 0.81 CNR2 (0.47) CNR2MEN1ALDH1A1KMT2A
SCHEMBL4648684 0.81 CNR2 (0.47) CNR2MEN1KMT2A
SCHEMBL4649728 0.78 THRB (0.47) CNR2MEN1ALDH1A1KMT2APOLB
SCHEMBL4650388 0.76 CNR2 (0.76) CNR2KMONPC1RAB9APOLB
SCHEMBL4649082 0.76 CNR2 (0.47) CNR2MEN1ALDH1A1KMT2A
SCHEMBL4650389 0.76 CNR2 (0.47) CNR2MEN1KMT2A
SCHEMBL4649775 0.75 CNR2 (0.40) CNR2KMOCHRNB4CHRNA3MEN1
SCHEMBL4649785 0.74 CNR2 (0.50) CNR2
SCHEMBL14005975 0.70 CNR2 (0.51) CNR2

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080280868-A1 Pyridine Derivatives and Their Use as Cb2 Receptor Modulators GLAXO GROUP LIMITED (GB) 2008-11-13 US disclosed
US-20080280868-A1 Pyridine Derivatives and Their Use as Cb2 Receptor Modulators GLAXO GROUP LIMITED (GB) 2008-11-13 US disclosed
US-20080280868-A1 Pyridine Derivatives and Their Use as Cb2 Receptor Modulators GLAXO GROUP LIMITED (GB) 2008-11-13 US disclosed
EP-1718613-B1 PYRIDINE DERIVATIVES AND THEIR USE AS CB2 RECEPTOR MODULATORS GLAXO GROUP LTD (GB) 2008-09-03 EP disclosed
EP-1718613-B1 PYRIDINE DERIVATIVES AND THEIR USE AS CB2 RECEPTOR MODULATORS GLAXO GROUP LTD (GB) 2008-09-03 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-20080280868-A1 Pyridine Derivatives and Their Use as Cb2 Receptor Modulators CNR2, CNR1, TRPV1 CNR2 1/4885KMO 1440/4885CHRNB4 180/4885

“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.