SCHEMBL23212972

SCHEMBL23212972

O=C(O)N1CC2(CC(N3CCC(c4ccccc4CC4CCOCC4)CC3)CO2)C1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 9/20 0.54
CHRM1 P11229 9/20 0.54
CHRM2 P08172 3/20 0.42
DRD2 P14416 7/20 0.33
HTR2A P28223 7/20 0.33
DRD3 P35462 7/20 0.33
ALDH1A1 P00352 2/20 0.32
POLB P06746 2/20 0.32
KDM4E B2RXH2 1/20 0.32
BRD4 O60885 1/20 0.32
CREBBP Q92793 1/20 0.32
CHRM5 P08912 1/20 0.32
CCR3 P51677 1/20 0.32
CNR1 P21554 1/20 0.32
CNR2 P34972 1/20 0.32

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
SCHEMBL30828944 1.00 CHRM4 (0.54) CHRM4CHRM1CHRM2DRD2HTR2A
SCHEMBL23212969 1.00 CHRM4 (0.54) CHRM4CHRM1CHRM2DRD2HTR2A
SCHEMBL23213668 0.88 CHRM4 (0.61) CHRM4CHRM1CHRM2ALDH1A1CHRM5
SCHEMBL23213670 0.88 CHRM4 (0.61) CHRM4CHRM1CHRM2ALDH1A1CHRM5
SCHEMBL23213272 0.87 CHRM4 (0.53) CHRM4CHRM1CHRM2DRD2HTR2A
SCHEMBL23210089 0.84 CHRM4 (0.57) CHRM4CHRM1CHRM2DRD2HTR2A
SCHEMBL23210087 0.84 CHRM4 (0.57) CHRM4CHRM1CHRM2DRD2HTR2A
SCHEMBL23229981 0.84 CHRM4 (0.42) CHRM4CHRM1CHRM2DRD2HTR2A
SCHEMBL23295190 0.84 CHRM4 (0.42) CHRM4CHRM1CHRM2DRD2HTR2A
SCHEMBL29871408 0.83 CHRM4 (0.49) CHRM4CHRM1CHRM2KDM4E

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.