SCHEMBL12017242

SCHEMBL12017242

CCO[C@@H]1CN2CCC1CC2

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CHRM1 P11229 5/20 0.58
▸ CHRM2 P08172 4/20 0.58
▸ CHRM4 P08173 1/20 0.58
▸ CHRM5 P08912 1/20 0.58
▸ CHRM3 P20309 1/20 0.58
▸ MEN1 O00255 1/20 0.50
▸ CYP2D6 P10635 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ CHRNA7 P36544 1/20 0.42

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
SCHEMBL13300984 1.00 CHRM1 (0.58) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL9094744 1.00 CHRM1 (0.58) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL10569051 0.89 CHRM1 (0.47) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL12674256 0.85 CHRM1 (0.43) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL9097759 0.83 CHRM1 (0.55) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL13038562 0.83 CHRM1 (0.55) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL11849760 0.80 CHRM1 (0.54) CHRM1CHRM2CHRM4CHRM5CHRM3
Oxalic Acid SCHEMBL10569543 0.80 CHRM1 (0.51) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL9289352 0.79 CHRM2 (0.55) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL96686 0.79 CHRM2 (0.55) CHRM1CHRM2CHRM4CHRM5CHRM3

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-20220023273-A1 METHODS FOR TREATING SYMPTOMS AND DISORDERS ASSOCIATED WITH LYSOSOMAL STORAGE DISEASES GENZYME CORPORATION (US) 2022-01-27 — — US disclosed
US-20170334903-A1 METHOD OF PREPARING GLUCOSYLCERAMIDE SYNTHASE INHIBITORS GENZYME CORPORATION (US) 2017-11-23 — — US disclosed
US-9682975-B2 Method of preparing glucosylceramide synthase inhibitors GENZYME CORPORATION (US) 2017-06-20 — — US disclosed
US-9012451-B2 Aza-bicycloalkyl ethers and their use as ALPHA7-nachr agonists NOVARTIS AG (CH) 2015-04-21 — — US disclosed
US-20120220599-A1 AZA-BICYCLOALKYL ETHERS AND THEIR USE AS ALPHA7-NACHR AGONISTS NOVARTIS AG 2012-08-30 — — 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 (3 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-20170334903-A1 METHOD OF PREPARING GLUCOSYLCERAMIDE SYNTHASE INHIBITORS GBA1, GBA2, GAA CHRM1 4833/4885CHRM2 4811/4885CHRM4 4850/4885
US-20120220599-A1 AZA-BICYCLOALKYL ETHERS AND THEIR USE AS ALPHA7-NACHR AGONISTS CHRNA7, CHRNA1, CHRNE CHRM1 18/4885CHRM2 21/4885CHRM4 20/4885
US-20220023273-A1 METHODS FOR TREATING SYMPTOMS AND DISORDERS ASSOCIATED WITH LYSOSOMAL STORAGE DISEASES GAA, GBA1, CMA1 CHRM1 2922/4885CHRM2 2794/4885CHRM4 3499/4885

“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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