SCHEMBL4936005

SCHEMBL4936005

O=C(NCC1CCOCC1)c1ccc(Nc2cccc(C(F)(F)F)c2)nc1C1CC1

nearest known ligand 0.71

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 19/20 0.71
CYP2D6 P10635 4/20 0.55
CYP2C19 P33261 4/20 0.55
CYP2C9 P11712 3/20 0.55
CYP3A4 P08684 2/20 0.55
CYP1A2 P05177 3/20 0.53

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
SCHEMBL4932524 0.87 CNR2 (0.72) CNR2CYP2D6CYP2C19CYP2C9CYP3A4
SCHEMBL4650498 0.86 CNR2 (0.70) CNR2CYP2D6CYP2C19CYP2C9CYP3A4
SCHEMBL4649634 0.86 CNR2 (0.70) CNR2CYP2D6CYP2C19CYP2C9CYP3A4
SCHEMBL4931244 0.83 CNR2 (1.00) CNR2CYP2D6CYP2C19CYP2C9CYP3A4
SCHEMBL4648968 0.83 CNR2 (0.58) CNR2CYP2D6CYP2C19CYP2C9CYP3A4
SCHEMBL4648729 0.81 CNR2 (0.69) CNR2CYP2D6CYP2C19CYP2C9CYP3A4
SCHEMBL4929647 0.81 CNR2 (0.64) CNR2CYP2D6CYP2C19CYP2C9CYP3A4
SCHEMBL4926710 0.80 CNR2 (0.93) CNR2CYP2D6CYP2C19CYP2C9CYP3A4
SCHEMBL5077103 0.80 CNR2 (0.76) CNR2CYP2D6CYP2C19CYP2C9CYP3A4
SCHEMBL5214859 0.78 CNR2 (0.78) CNR2CYP2D6CYP2C19CYP2C9CYP3A4

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-20080280952-A1 Pyridine Derivatives as Connabinoid Receptor Modulators GLAXO GROUP LIMITED (GB) 2008-11-13 US disclosed
US-20080280952-A1 Pyridine Derivatives as Connabinoid Receptor Modulators GLAXO GROUP LIMITED (GB) 2008-11-13 US disclosed
US-20080280952-A1 Pyridine Derivatives as Connabinoid Receptor Modulators GLAXO GROUP LIMITED (GB) 2008-11-13 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-20080280952-A1 Pyridine Derivatives as Connabinoid Receptor Modulators CNR1, CNR2, P2RY1 CNR2 2/4885CYP2D6 1087/4885CYP2C19 498/4885

“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.