SCHEMBL5779676

SCHEMBL5779676

O=C(NCc1ccc(F)cc1)c1cnc(Nc2ccc(Cl)c(Cl)c2)nc1C(F)(F)F

nearest known ligand 0.78

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 19/20 0.78
CYP1A2 P05177 3/20 0.78
CYP2C9 P11712 2/20 0.78
CYP2C19 P33261 2/20 0.78
CYP3A4 P08684 1/20 0.78
CYP2D6 P10635 1/20 0.78
GLA P06280 1/20 0.54

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
SCHEMBL5778818 0.93 CNR2 (0.80) CNR2CYP1A2CYP2C9CYP2C19CYP3A4
SCHEMBL5083119 0.91 CNR2 (0.80) CNR2CYP1A2CYP2C9CYP2C19CYP3A4
SCHEMBL5780443 0.89 CNR2 (0.71) CNR2CYP1A2CYP2C9CYP2C19CYP3A4
SCHEMBL5777732 0.89 CNR2 (0.71) CNR2CYP1A2CYP2C9CYP2C19CYP3A4
SCHEMBL5780836 0.89 CNR2 (0.79) CNR2CYP1A2CYP2C9CYP2C19CYP3A4
SCHEMBL5079086 0.88 CNR2 (0.84) CNR2CYP1A2CYP2C9CYP2C19CYP3A4
SCHEMBL5083343 0.88 CNR2 (1.00) CNR2CYP1A2CYP2C9CYP2C19CYP3A4
SCHEMBL5781604 0.87 CNR2 (0.75) CNR2CYP1A2CYP2C9CYP2C19CYP3A4
SCHEMBL5777340 0.86 CNR2 (0.72) CNR2CYP1A2CYP2C9CYP2C19CYP3A4
SCHEMBL5079867 0.86 CNR2 (0.89) CNR2CYP1A2CYP2C9CYP2C19CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1736470-A2 Pyrimidine derivatives as CB2 cannabinoid receptor modulators GLAXO GROUP LIMITED (GB) 2006-12-27 EP disclosed
US-20060247261-A1 Pyrimidine compounds GLAXO GROUP LIMITED (GB) 2006-11-02 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-20060247261-A1 Pyrimidine compounds CNR2, CNR1, P2RX5 CNR2 1/4885CYP1A2 1729/4885CYP2C9 1163/4885

“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.