SCHEMBL19965819

SCHEMBL19965819

CCOC(=O)N1CCC(N2CCC3(CC2)OC(=O)N(CC)C3(C)C)CC1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 3/20 0.47
MAPK1 P28482 1/20 0.45
TP53 P04637 2/20 0.45
TDP1 Q9NUW8 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.43
GAA P10253 2/20 0.43
ALOX12 P18054 1/20 0.43
CHRM2 P08172 4/20 0.42
CHRM4 P08173 1/20 0.42
CHRM5 P08912 1/20 0.42
CHRM3 P20309 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
POLB P06746 1/20 0.41
KDM4E B2RXH2 3/20 0.41
ALDH1A1 P00352 3/20 0.41

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
SCHEMBL18075969 0.86 CHRM4 (0.39) CHRM1MAPK1TP53TDP1CHRM2
SCHEMBL18075980 0.86 CHRM4 (0.41) CHRM1MAPK1TP53TDP1CHRM2
SCHEMBL18075955 0.84 CHRM4 (0.46) CHRM1MAPK1TP53CHRM2CHRM4
SCHEMBL19965818 0.79 CHRM1 (0.48) CHRM1MAPK1TP53TDP1SMN1; SMN2
SCHEMBL18075927 0.77 CHRM4 (0.45) CHRM1MAPK1CHRM2CHRM4CHRM5
SCHEMBL18075931 0.77 CHRM4 (0.45) CHRM1MAPK1CHRM2CHRM4CHRM5
SCHEMBL18075949 0.76 CHRM4 (0.40) CHRM1MAPK1CHRM2CHRM4ALDH1A1
SCHEMBL18075967 0.76 CHRM4 (0.44) CHRM1MAPK1CHRM2CHRM4L3MBTL1
SCHEMBL18075923 0.75 CHRM4 (0.43) CHRM1MAPK1CHRM2CHRM4POLB
SCHEMBL19965821 0.75 CCR5 (0.47) CHRM1MAPK1TP53TDP1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3271358-B1 SPIROCYCLIC COMPOUNDS AS AGONISTS OF THE MUSCARINIC M1 RECEPTOR AND/OR M4 RECEPTOR HEPTARES THERAPEUTICS LTD (GB) 2020-11-18 EP disclosed
US-10167284-B2 Spirocyclic compounds as agonists of the muscarinic M1 receptor and/or M4 receptor HEPTARES THERAPEUTICS LIMITED (GB) 2019-01-01 US disclosed
US-20180072727-A1 SPIROCYCLIC COMPOUNDS AS AGONISTS OF THE MUSCARINIC M1 RECEPTOR AND/OR M4 RECEPTOR NXERA PHARMA UK LIMITED (GB) 2018-03-15 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-10167284-B2 Spirocyclic compounds as agonists of the muscarinic M1 receptor and/or M4 receptor CHRM1, CHRM2, CHRM4 CHRM1 1/4885MAPK1 2319/4885TP53 2027/4885
US-20180072727-A1 SPIROCYCLIC COMPOUNDS AS AGONISTS OF THE MUSCARINIC M1 RECEPTOR AND/OR M4 RECEPTOR CHRM1, CHRM2, CHRM4 CHRM1 1/4885MAPK1 2281/4885TP53 2190/4885

“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.