SCHEMBL20909164

SCHEMBL20909164

CCOC(=O)N1CCC2(CC(N3CCC([C@@H]4CCCN4C(=O)OCC)CC3)C2)C1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CHRM4 P08173 7/20 0.53
▸ CHRM2 P08172 4/20 0.44
▸ CHRM1 P11229 6/20 0.40
▸ TP53 P04637 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ MAPK1 P28482 1/20 0.37
▸ ALDH1A1 P00352 5/20 0.36
▸ KDM4E B2RXH2 3/20 0.36
▸ CHRM5 P08912 1/20 0.35
▸ CHRM3 P20309 1/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ POLB P06746 1/20 0.35

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
SCHEMBL16992560 1.00 CHRM4 (0.53) CHRM4CHRM2CHRM1TP53TDP1
SCHEMBL16992382 0.95 CHRM4 (0.53) CHRM4CHRM2CHRM1TP53TDP1
SCHEMBL16992516 0.95 CHRM4 (0.53) CHRM4CHRM2CHRM1TP53TDP1
SCHEMBL16992453 0.95 CHRM4 (0.53) CHRM4CHRM2CHRM1TP53TDP1
SCHEMBL20292064 0.94 CHRM4 (0.47) CHRM4CHRM2CHRM1TP53TDP1
SCHEMBL16992364 0.94 CHRM4 (0.52) CHRM4CHRM2CHRM1TP53TDP1
SCHEMBL17001974 0.93 CHRM4 (0.48) CHRM4CHRM2CHRM1TP53TDP1
SCHEMBL16992497 0.93 CHRM4 (0.50) CHRM4CHRM2CHRM1TP53TDP1
SCHEMBL17001976 0.93 CHRM4 (0.50) CHRM4CHRM2CHRM1TP53TDP1
SCHEMBL16992172 0.93 CHRM4 (0.48) CHRM4CHRM2CHRM1TP53TDP1

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-10385039-B2 Bicyclic aza compounds as muscarnic M1 receptor and/or M4 receptor antagonists HEPTARES THERAPEUTICS LIMITED (GB) 2019-08-20 — — US disclosed
US-20190112294-A1 BICYCLIC AZA COMPOUNDS AS MUSCARNIC M1 RECEPTOR AND/OR M4 RECEPTOR ANTAGONISTS NXERA PHARMA UK LIMITED (GB) 2019-04-18 — — 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 (2 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-20190112294-A1 BICYCLIC AZA COMPOUNDS AS MUSCARNIC M1 RECEPTOR AND/OR M4 RECEPTOR ANTAGONISTS CHRM1, CHRM2, CHRM5 CHRM4 4/4885CHRM2 2/4885CHRM1 1/4885
US-10385039-B2 Bicyclic aza compounds as muscarnic M1 receptor and/or M4 receptor antagonists CHRM1, CHRM2, CHRM5 CHRM4 4/4885CHRM2 2/4885CHRM1 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.

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