SCHEMBL3206963

SCHEMBL3206963

FC(F)(F)c1ccc(O[C@H]2CN3CCC2CC3)cc1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LSS P48449 1/20 0.53
CHRNA7 P36544 1/20 0.47
NTMT1 Q9BV86 1/20 0.42
CHRM2 P08172 2/20 0.42
CHRM1 P11229 2/20 0.42
CHRM3 P20309 2/20 0.42
CHRM4 P08173 1/20 0.42
CHRM5 P08912 1/20 0.42

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
SCHEMBL3206972 1.00 LSS (0.53) LSSCHRNA7NTMT1CHRM2CHRM1
Hydrochloric Acid SCHEMBL9469873 0.98 LSS (0.52) LSSCHRNA7NTMT1CHRM2CHRM1
SCHEMBL5397106 0.96 LSS (0.50) LSSCHRNA7NTMT1
Hydrochloric Acid SCHEMBL5651698 0.94 LSS (0.49) LSSCHRNA7NTMT1
SCHEMBL13165332 0.84 LSS (0.53) LSSCHRNA7
SCHEMBL13429312 0.82 SLC6A2 (0.49) LSSCHRM2CHRM1CHRM3CHRM4
SCHEMBL1849255 0.82 LSS (0.57) LSSCHRNA7CHRM2CHRM1CHRM3
SCHEMBL1849257 0.82 LSS (0.57) LSSCHRNA7CHRM2CHRM1CHRM3
SCHEMBL5390772 0.82 LSS (0.60) LSSCHRNA7
Hydrochloric Acid SCHEMBL9469184 0.81 SLC6A2 (0.48) CHRM2CHRM1CHRM3CHRM4CHRM5

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-20100056565-A1 Heterocyclic Derivatives as M3 Muscarinic Receptors ARGENTA DISCOVERY LIMITED (GB) 2010-03-04 US disclosed
EP-2121688-A1 HETEROCYCLIC DERIVATIVES AS M3 MUSCARINIC RECEPTORS Argenta Discovery Ltd (GB) 2009-11-25 EP disclosed
WO-2008099186-A1 HETEROCYCLIC DERIVATIVES AS M3 MUSCARINIC RECEPTORS ARGENTA DISCOVERY LIMITED (GB) 2008-08-21 WO 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-20100056565-A1 Heterocyclic Derivatives as M3 Muscarinic Receptors CHRM2, CHRM3, CHRM1 LSS 4700/4885CHRNA7 13/4885NTMT1 1247/4885

“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.