SCHEMBL23213744

SCHEMBL23213744

c1ccc(C2CCN(C3COC4(CNC4)C3)CC2)c(-c2cncnc2)c1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 5/20 0.43
CHRM1 P11229 5/20 0.43
ADRA1D P25100 1/20 0.38
ADRA1A P35348 1/20 0.38
ROCK2 O75116 7/20 0.34
ROCK1 Q13464 7/20 0.34
CDC42BPB Q9Y5S2 7/20 0.34
CDC42BPA Q5VT25 5/20 0.33
CHRM2 P08172 2/20 0.33
MAPKAPK2 P49137 4/20 0.33
ZAP70 P43403 1/20 0.31
PDE9A O76083 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
SCHEMBL23213740 1.00 CHRM4 (0.43) CHRM4CHRM1ADRA1DADRA1AROCK2
SCHEMBL23213423 0.83 CHRM4 (0.54) CHRM4CHRM1ADRA1DADRA1ACHRM2
SCHEMBL23213418 0.83 CHRM4 (0.54) CHRM4CHRM1ADRA1DADRA1ACHRM2
SCHEMBL23213160 0.80 CHRM4 (0.43) CHRM4CHRM1ADRA1DADRA1ACHRM2
SCHEMBL23213025 0.80 CHRM4 (0.43) CHRM4CHRM1ADRA1DADRA1AROCK2
SCHEMBL23213410 0.80 ADRA1A (0.43) CHRM4CHRM1ADRA1DADRA1ACHRM2
SCHEMBL23213413 0.80 ADRA1A (0.43) CHRM4CHRM1ADRA1DADRA1ACHRM2
SCHEMBL23213474 0.79 CHRM4 (0.48) CHRM4CHRM1CHRM2
SCHEMBL23213478 0.79 CHRM4 (0.48) CHRM4CHRM1CHRM2
SCHEMBL23213341 0.78 CHRM4 (0.42) CHRM4CHRM1CHRM2

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 7 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-11485742-B2 2-azaspiro[3.4]octane derivatives as M4 agonists NOVARTIS AG (CH) 2022-11-01 US disclosed
EP-4041737-A1 5-OXA-2-AZASPIRO[3.4]OCTANE DERIVATIVES AS M4 AGONISTS Novartis AG (CH) 2022-08-17 EP 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 (5 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-11485742-B2 2-azaspiro[3.4]octane derivatives as M4 agonists CHRM2, CHRM1, CHRM3 CHRM4 4/4885CHRM1 2/4885ADRA1D 19/4885
US-20240140959-A1 2-AZASPIRO[3.4]OCTANE DERIVATIVES AS M4 AGONISTS CHRM2, CHRM1, CHRM3 CHRM4 4/4885CHRM1 2/4885ADRA1D 19/4885
US-20210130365-A1 2-AZASPIRO[3.4]OCTANE DERIVATIVES AS M4 AGONISTS CHRM2, CHRM1, CHRM3 CHRM4 4/4885CHRM1 2/4885ADRA1D 19/4885
US-20220411435-A1 2-AZASPIRO[3,4]OCTANE DERIVATIVES AS M4 AGONISTS CHRM2, CHRM1, CHRM3 CHRM4 4/4885CHRM1 2/4885ADRA1D 20/4885
US-11820778-B2 2-azaspiro[3.4]octane derivatives as M4 agonists CHRM2, CHRM1, CHRM3 CHRM4 4/4885CHRM1 2/4885ADRA1D 19/4885

“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.