SCHEMBL25817119

SCHEMBL25817119

Cc1cc(C2CCN([C@@H]3CCC4(C3)CN(C(=O)OC(C)(C)C)C4)CC2)c(OCc2ccccc2)c(C)c1C

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 9/20 0.49
CHRM1 P11229 6/20 0.49
CHRM2 P08172 3/20 0.45
YAP1 P46937 3/20 0.40
CHRM5 P08912 1/20 0.39
PRMT5 O14744 2/20 0.39
GPR119 Q8TDV5 3/20 0.37
STS P08842 1/20 0.37
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36
POLB P06746 1/20 0.36
MAPT P10636 1/20 0.36

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
SCHEMBL26780879 0.86 CHRM4 (0.46) CHRM4CHRM1CHRM2YAP1PRMT5
SCHEMBL26781063 0.86 CHRM4 (0.46) CHRM4CHRM1CHRM2YAP1PRMT5
SCHEMBL23228635 0.85 CHRM4 (0.65) CHRM4CHRM1CHRM2YAP1CHRM5
SCHEMBL23228671 0.85 CHRM4 (0.51) CHRM4CHRM1CHRM2YAP1CHRM5
SCHEMBL25817192 0.84 CHRM4 (0.47) CHRM4CHRM1CHRM2CHRM5MAPT
SCHEMBL25817113 0.83 CHRM4 (0.42) CHRM4CHRM1CHRM2CHRM5LMNA
SCHEMBL23228668 0.83 CHRM4 (0.55) CHRM4CHRM1CHRM2YAP1CHRM5
SCHEMBL23228670 0.83 CHRM4 (0.55) CHRM4CHRM1CHRM2YAP1CHRM5
SCHEMBL25817176 0.83 CHRM4 (0.42) CHRM4CHRM1CHRM2CHRM5GPR119
SCHEMBL25817141 0.82 CHRM4 (0.46) CHRM4CHRM1CHRM2CHRM5MAPT

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230212139-A1 2-AZASPIRO[3.4]OCTANE DERIVATIVES AS M4 AGONISTS NOVARTIS INSTITUTES FOR BIOMEDICAL RESEARCH, INC. 2023-07-06 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-20230212139-A1 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.