SCHEMBL23744614

SCHEMBL23744614

COc1cncc(N2C[C@@H](C)N(C(=O)OC3CCN(Cc4ccccc4)CC3)C[C@@H]2C)n1

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 12/20 0.47
HRH3 Q9Y5N1 2/20 0.44
BCHE P06276 2/20 0.42
CHRM2 P08172 1/20 0.39
CHRM1 P11229 1/20 0.39
CHRM3 P20309 1/20 0.39

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
SCHEMBL23744618 1.00 CHRM4 (0.47) CHRM4HRH3BCHECHRM2CHRM1
SCHEMBL26429414 0.87 CHRM4 (0.39) CHRM4HRH3
SCHEMBL26429417 0.87 CHRM4 (0.39) CHRM4HRH3
SCHEMBL23744649 0.86 CHRM2 (0.45) CHRM4BCHECHRM2CHRM1CHRM3
SCHEMBL23744653 0.86 CHRM2 (0.45) CHRM4BCHECHRM2CHRM1CHRM3
SCHEMBL23744257 0.84 HCAR2 (0.51) CHRM4BCHECHRM2CHRM1
SCHEMBL23744259 0.84 HCAR2 (0.51) CHRM4BCHECHRM2CHRM1
SCHEMBL23744486 0.82 HCAR2 (0.42) CHRM4BCHE
SCHEMBL23744584 0.82 HCAR2 (0.42) CHRM4BCHE
SCHEMBL23744451 0.80 HCAR2 (0.44) CHRM4BCHECHRM2CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230129359-A1 MUSCARINIC RECEPTOR 4 ANTAGONISTS AND METHODS OF USE NEUROCRINE BIOSCIENCES, INC. 2023-04-27 US disclosed
WO-2021158698-A1 MUSCARINIC RECEPTOR 4 ANTAGONISTS AND METHODS OF USE NEUROCRINE BIOSCIENCES, INC. (US) 2021-08-12 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-20230129359-A1 MUSCARINIC RECEPTOR 4 ANTAGONISTS AND METHODS OF USE CHRM4, CHRM2, CHRM5 CHRM4 1/4885HRH3 104/4885BCHE 141/4885

“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.