SCHEMBL22472877

SCHEMBL22472877

COC(=O)N1C2COCC1CC(N1CCC(C(=O)NCC(C)C)CC1)C2

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.38
CHRM1 P11229 1/20 0.38
USP2 O75604 1/20 0.38
HPGD P15428 1/20 0.38
EPHX2 P34913 1/20 0.38
LMNA P02545 1/20 0.37
GAA P10253 1/20 0.37
RAB9A P51151 1/20 0.37
HSD17B10 Q99714 1/20 0.35
KDM4E B2RXH2 2/20 0.35
CYP3A4 P08684 1/20 0.34
ALDH1A1 P00352 2/20 0.33
KMT2A Q03164 1/20 0.33
WNT1 P04628 1/20 0.33
GSK3B P49841 1/20 0.33
DYRK1A Q13627 1/20 0.33
MTNR1A P48039 2/20 0.33
MTNR1B P49286 2/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL21597937 0.91 CHRM1 (0.48) SMN1; SMN2CHRM1USP2HPGDEPHX2
SCHEMBL27176060 0.88 SMN1; SMN2 (0.39) SMN1; SMN2USP2HPGDEPHX2LMNA
SCHEMBL22472879 0.84 EPHX2 (0.39) SMN1; SMN2CHRM1USP2HPGDEPHX2
SCHEMBL22472868 0.84 MAPT (0.43) SMN1; SMN2CHRM1EPHX2GAAKDM4E
SCHEMBL22472936 0.77 CHRM1 (0.53) CHRM1KMT2AWNT1GSK3BDYRK1A
SCHEMBL22472933 0.76 HPGD (0.44) SMN1; SMN2CHRM1HPGDLMNAALDH1A1
SCHEMBL21597906 0.76 CHRM1 (0.49) CHRM1EPHX2GAA
SCHEMBL22472884 0.75 CHRM1 (0.46) SMN1; SMN2CHRM1EPHX2LMNAGAA
SCHEMBL22449312 0.75 PIK3CD (0.49) LMNAKMT2A
SCHEMBL31288593 0.74 CHRM1 (0.32) CHRM1LMNAWNT1GSK3BDYRK1A

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 6 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 claimed
EP-3810614-B1 BRIDGED COMPOUNDS AS AGONISTS OF THE MUSCARINIC M1 AND/OR M4 RECEPTOR HEPTARES THERAPEUTICS LTD (GB) 2024-03-27 EP claimed
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-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

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 SMN1; SMN2 2514/4885CHRM1 1/4885USP2 4337/4885
US-20210002271-A1 PHARMACEUTICAL COMPOUNDS CHRM1, CHRM2, CHRM4 SMN1; SMN2 2514/4885CHRM1 1/4885USP2 4337/4885
US-10787447-B2 Pharmaceutical compounds CHRM1, CHRM2, CHRM4 SMN1; SMN2 2514/4885CHRM1 1/4885USP2 4337/4885

“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.