SCHEMBL21597928

SCHEMBL21597928

CCOC(=O)C1CCN(C2CC3COCC(C2)N3C(=O)OCC)CC1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.48
CHRM1 P11229 6/20 0.45
ALDH1A1 P00352 5/20 0.44
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
NPC1 O15118 2/20 0.41
RAB9A P51151 1/20 0.41
KMT2A Q03164 1/20 0.41
KDM4E B2RXH2 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
LIPE Q05469 1/20 0.40

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
SCHEMBL15618889 0.89 MAPT (0.52) MAPTCHRM1ALDH1A1CYP3A4CYP2D6
SCHEMBL25307693 0.87 MAPT (0.54) MAPTCHRM1ALDH1A1CYP3A4CYP2D6
SCHEMBL21597933 0.84 ALDH1A1 (0.50) MAPTCHRM1ALDH1A1KMT2A
SCHEMBL21597937 0.82 CHRM1 (0.48) CHRM1ALDH1A1SMN1; SMN2
SCHEMBL31288731 0.82 CHRM1 (0.39) MAPTCHRM1ALDH1A1
SCHEMBL21061885 0.81 MAPT (0.50) MAPTCHRM1ALDH1A1CYP3A4CYP2D6
SCHEMBL21061543 0.81 MAPT (0.50) MAPTCHRM1ALDH1A1CYP3A4CYP2D6
SCHEMBL21597906 0.81 CHRM1 (0.49) MAPTCHRM1
SCHEMBL22449320 0.80 CHRM1 (0.40) MAPTCHRM1NPC1RAB9AKMT2A
SCHEMBL21597926 0.80 CHRM1 (0.63) CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112585143-B Bridging compounds as agonists of muscarinic M1 and/or M4 receptors 奈克斯拉制药英国有限公司 2024-11-12 CN disclosed
EP-3810614-B1 BRIDGED COMPOUNDS AS AGONISTS OF THE MUSCARINIC M1 AND/OR M4 RECEPTOR HEPTARES THERAPEUTICS LTD (GB) 2024-03-27 EP disclosed
US-11773090-B2 Pharmaceutical compounds HEPTARES THERAPEUTICS LIMITED (GB) 2023-10-03 US disclosed
US-11773090-B2 Pharmaceutical compounds HEPTARES THERAPEUTICS LIMITED (GB) 2023-10-03 US disclosed
US-11773090-B2 Pharmaceutical compounds HEPTARES THERAPEUTICS LIMITED (GB) 2023-10-03 US disclosed
EP-3810614-A1 BRIDGED COMPOUNDS AS AGONISTS OF THE MUSCARINIC M1 AND/OR M4 RECEPTOR Heptares Therapeutics Limited (GB) 2021-04-28 EP disclosed
US-20210002271-A1 PHARMACEUTICAL COMPOUNDS NXERA PHARMA UK LIMITED (GB) 2021-01-07 US disclosed
US-20210002271-A1 PHARMACEUTICAL COMPOUNDS NXERA PHARMA UK LIMITED (GB) 2021-01-07 US disclosed
US-10787447-B2 Pharmaceutical compounds HEPTARES THERAPEUTICS LIMITED (GB) 2020-09-29 US disclosed
US-10787447-B2 Pharmaceutical compounds HEPTARES THERAPEUTICS LIMITED (GB) 2020-09-29 US disclosed
WO-2019243851-A1 BRIDGED COMPOUNDS AS AGONISTS OF THE MUSCARINIC M1 AND/OR M4 RECEPTOR HEPTARES THERAPEUTICS LIMITED (GB) 2019-12-26 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 (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-11773090-B2 Pharmaceutical compounds CHRM1, CHRM2, CHRM4 MAPT 1215/4885CHRM1 1/4885ALDH1A1 2016/4885
US-20210002271-A1 PHARMACEUTICAL COMPOUNDS CHRM1, CHRM2, CHRM4 MAPT 1215/4885CHRM1 1/4885ALDH1A1 2016/4885
US-10787447-B2 Pharmaceutical compounds CHRM1, CHRM2, CHRM4 MAPT 1215/4885CHRM1 1/4885ALDH1A1 2016/4885

“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.