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Sugi Predict / Compounds / SCHEMBL23213203

SCHEMBL23213203

SCHEMBL23213203

O=C(O)N1CC2(C[C@H](N3CCC(c4cc(F)ccc4OS(=O)(=O)C(F)(F)F)CC3)CO2)C1

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CHRM4 P08173 9/20 0.63
▸ CHRM1 P11229 9/20 0.63
▸ CHRM2 P08172 3/20 0.47
▸ CHRM5 P08912 1/20 0.47
▸ PTGDR2 Q9Y5Y4 2/20 0.36
▸ DRD2 P14416 6/20 0.35
▸ ADRA1D P25100 4/20 0.35
▸ ADRA1A P35348 4/20 0.35
▸ ADRA1B P35368 4/20 0.35
▸ DRD1 P21728 2/20 0.34
▸ DRD4 P21917 2/20 0.34
▸ DRD5 P21918 2/20 0.34
▸ DRD3 P35462 2/20 0.34
▸ RBP4 P02753 2/20 0.32
▸ MGLL Q99685 1/20 0.31

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
SCHEMBL23213205 1.00 CHRM4 (0.63) CHRM4CHRM1CHRM2CHRM5PTGDR2
SCHEMBL23213089 0.90 CHRM4 (0.60) CHRM4CHRM1CHRM2CHRM5DRD2
SCHEMBL23213092 0.90 CHRM4 (0.60) CHRM4CHRM1CHRM2CHRM5DRD2
SCHEMBL26781329 0.90 CHRM4 (0.60) CHRM4CHRM1CHRM2CHRM5DRD2
SCHEMBL23213110 0.87 CHRM4 (0.82) CHRM4CHRM1CHRM2CHRM5PTGDR2
SCHEMBL23213106 0.87 CHRM4 (0.82) CHRM4CHRM1CHRM2CHRM5PTGDR2
SCHEMBL23213201 0.85 CHRM4 (0.68) CHRM4CHRM1CHRM2CHRM5PTGDR2
SCHEMBL23213199 0.85 CHRM4 (0.68) CHRM4CHRM1CHRM2CHRM5PTGDR2
SCHEMBL23213492 0.83 CHRM4 (0.63) CHRM4CHRM1CHRM2CHRM5PTGDR2
SCHEMBL23213267 0.82 CHRM4 (0.61) CHRM4CHRM1CHRM2CHRM5PTGDR2

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-20240140959-A1 2-AZASPIRO[3.4]OCTANE DERIVATIVES AS M4 AGONISTS NOVARTIS AG (CH) 2024-05-02 — — US disclosed
US-11820778-B2 2-azaspiro[3.4]octane derivatives as M4 agonists NOVARTIS AG (CH) 2023-11-21 — — US disclosed
US-20220411435-A1 2-AZASPIRO[3,4]OCTANE DERIVATIVES AS M4 AGONISTS NOVARTIS INSTITUTES FOR BIOMEDICAL RESEARCH, INC. 2022-12-29 — — US disclosed
US-20210130365-A1 2-AZASPIRO[3.4]OCTANE DERIVATIVES AS M4 AGONISTS NOVARTIS INSTITUTES FOR BIOMEDICAL RESEARCH, INC. 2021-05-06 — — US disclosed
WO-2021070091-A1 5-OXA-2-AZASPIRO[3.4]OCTANE DERIVATIVES AS M4 AGONISTS NOVARTIS AG (CH) 2021-04-15 — — 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 (4 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-20240140959-A1 2-AZASPIRO[3.4]OCTANE DERIVATIVES AS M4 AGONISTS CHRM2, CHRM1, CHRM3 CHRM4 4/4885CHRM1 2/4885CHRM2 1/4885
US-20210130365-A1 2-AZASPIRO[3.4]OCTANE DERIVATIVES AS M4 AGONISTS CHRM2, CHRM1, CHRM3 CHRM4 4/4885CHRM1 2/4885CHRM2 1/4885
US-20220411435-A1 2-AZASPIRO[3,4]OCTANE DERIVATIVES AS M4 AGONISTS CHRM2, CHRM1, CHRM3 CHRM4 4/4885CHRM1 2/4885CHRM2 1/4885
US-11820778-B2 2-azaspiro[3.4]octane derivatives as M4 agonists CHRM2, CHRM1, CHRM3 CHRM4 4/4885CHRM1 2/4885CHRM2 1/4885

“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.