SCHEMBL3227752

SCHEMBL3227752

CN1CCC[C@H]1COc1ccccc1C(=O)/[N+](=c1/oc(C(C)(C)C)cn1CC1CCC1)C(F)(F)F

nearest known ligand 0.49

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 13/20 0.45
CHRNB4 P30926 1/20 0.40
CHRNA3 P32297 1/20 0.40

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
SCHEMBL283520 0.74 CNR2 (0.64) CNR2
SCHEMBL283521 0.74 CNR2 (0.64) CNR2
SCHEMBL3227757 0.73 CNR2 (0.46) CNR2
SCHEMBL3227747 0.73 CNR2 (0.46) CNR2
SCHEMBL26729833 0.68 CHRNB4 (0.65) CHRNB4CHRNA3
SCHEMBL32691652 0.68 CHRNB4 (0.67) CHRNB4CHRNA3
SCHEMBL283974 0.65 CNR2 (0.72) CNR2
SCHEMBL283975 0.65 CNR2 (0.72) CNR2
SCHEMBL283249 0.65 CNR2 (0.74) CNR2
SCHEMBL283248 0.65 CNR2 (0.74) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8188135-B2 Compounds as cannabinoid receptor ligands ABBOTT LABORATORIES (US) 2012-05-29 US disclosed
US-20100069349-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2010-03-18 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-20100069349-A1 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS CNR1, CNR2, NPY1R CNR2 2/4885CHRNB4 68/4885CHRNA3 71/4885

“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.