SCHEMBL17101382

SCHEMBL17101382

CCOC(=O)N1CC2CC(N3CCC4(CC3)CNC(=O)C4)CC1C2

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 1/20 0.34
CYP11B2 P19099 1/20 0.34
CHRM1 P11229 5/20 0.33
CHRM4 P08173 3/20 0.33
CHRM2 P08172 2/20 0.33
CHRM5 P08912 1/20 0.33
CHRM3 P20309 1/20 0.33
ALDH1A1 P00352 1/20 0.32
GAA P10253 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
MAPK1 P28482 3/20 0.32
POLB P06746 2/20 0.31
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 1/20 0.31
LMNA P02545 3/20 0.31
PKM P14618 1/20 0.31
MAPT P10636 1/20 0.31
KCNH2 Q12809 1/20 0.31

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
SCHEMBL24248967 0.90 CYP11B1 (0.35) CYP11B1CYP11B2CHRM1CHRM4CHRM2
SCHEMBL17101361 0.89 CYP11B1 (0.33) CYP11B1CYP11B2
SCHEMBL23289893 0.84 CYP11B1 (0.33) CYP11B1CYP11B2
SCHEMBL17121803 0.84 CYP11B1 (0.33) CYP11B1CYP11B2CHRM1CHRM4CHRM2
SCHEMBL17101289 0.84 CHRM1 (0.42) CYP11B1CYP11B2CHRM1CHRM4CHRM2
SCHEMBL20942447 0.84 CHRM1 (0.42) CYP11B1CYP11B2CHRM1CHRM4CHRM2
SCHEMBL29859951 0.84 CHRM1 (0.42) CYP11B1CYP11B2CHRM1CHRM4CHRM2
SCHEMBL20942069 0.84 CHRM1 (0.42) CYP11B1CYP11B2CHRM1CHRM4CHRM2
SCHEMBL17101370 0.82 CHRM1 (0.40) CHRM1CHRM4CHRM2CHRM5CHRM3
SCHEMBL22472870 0.81 CYP11B1 (0.35) CYP11B1CYP11B2CHRM1CHRM4CHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11034704-B2 Muscarinic receptor agonists NXERA PHARMA UK LIMITED (GB) 2021-06-15 US claimed
EP-3119396-B1 MUSCARINIC RECEPTOR AGONISTS HEPTARES THERAPEUTICS LTD (GB) 2021-05-05 EP claimed
US-10428088-B2 Muscarinic receptor agonists HEPTARES THERAPEUTICS LIMITED (GB) 2019-10-01 US claimed
US-20180327426-A1 MUSCARINIC RECEPTOR AGONISTS NXERA PHARMA UK LIMITED (GB) 2018-11-15 US claimed
US-10030035-B2 Muscarinic receptor agonists HEPTARES THERAPEUTICS LIMITED (GB) 2018-07-24 US claimed
US-20170096437-A1 MUSCARINIC RECEPTOR AGONISTS NXERA PHARMA UK LIMITED (GB) 2017-04-06 US claimed
EP-3119396-A1 MUSCARINIC RECEPTOR AGONISTS Heptares Therapeutics Limited (GB) 2017-01-25 EP claimed
WO-2015140559-A1 MUSCARINIC RECEPTOR AGONISTS HEPTARES THERAPEUTICS LIMITED (GB) 2015-09-24 WO claimed
US-20220048928-A1 MUSCARINIC RECEPTOR AGONISTS NXERA PHARMA UK LIMITED (GB) 2022-02-17 US disclosed
US-11034704-B2 Muscarinic receptor agonists NXERA PHARMA UK LIMITED (GB) 2021-06-15 US disclosed
EP-3119396-B1 MUSCARINIC RECEPTOR AGONISTS HEPTARES THERAPEUTICS LTD (GB) 2021-05-05 EP disclosed
EP-3119396-B1 MUSCARINIC RECEPTOR AGONISTS HEPTARES THERAPEUTICS LTD (GB) 2021-05-05 EP disclosed
US-10501483-B2 Enamines and diastereo-selective reduction of enamines ALLERGAN, INC. (US) 2019-12-10 US disclosed
US-10428088-B2 Muscarinic receptor agonists HEPTARES THERAPEUTICS LIMITED (GB) 2019-10-01 US disclosed
US-10030035-B2 Muscarinic receptor agonists HEPTARES THERAPEUTICS LIMITED (GB) 2018-07-24 US disclosed
US-10030035-B2 Muscarinic receptor agonists HEPTARES THERAPEUTICS LIMITED (GB) 2018-07-24 US disclosed
US-20170096437-A1 MUSCARINIC RECEPTOR AGONISTS NXERA PHARMA UK LIMITED (GB) 2017-04-06 US disclosed
US-20170096437-A1 MUSCARINIC RECEPTOR AGONISTS NXERA PHARMA UK LIMITED (GB) 2017-04-06 US disclosed
WO-2015140559-A1 MUSCARINIC RECEPTOR AGONISTS HEPTARES THERAPEUTICS LIMITED (GB) 2015-09-24 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 (7 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-20170096437-A1 MUSCARINIC RECEPTOR AGONISTS CHRM1, CHRM2, CHRM3 CYP11B1 597/4885CYP11B2 617/4885CHRM1 1/4885
US-10428088-B2 Muscarinic receptor agonists CHRM1, CHRM2, CHRM3 CYP11B1 612/4885CYP11B2 634/4885CHRM1 1/4885
US-20220048928-A1 MUSCARINIC RECEPTOR AGONISTS CHRM1, CHRM2, CHRM3 CYP11B1 612/4885CYP11B2 634/4885CHRM1 1/4885
US-20180327426-A1 MUSCARINIC RECEPTOR AGONISTS CHRM1, CHRM2, CHRM3 CYP11B1 612/4885CYP11B2 634/4885CHRM1 1/4885
US-10030035-B2 Muscarinic receptor agonists CHRM1, CHRM2, CHRM3 CYP11B1 597/4885CYP11B2 617/4885CHRM1 1/4885
US-10501483-B2 Enamines and diastereo-selective reduction of enamines ENY2, PNMT, CHRM1 CYP11B1 836/4885CYP11B2 573/4885CHRM1 3/4885
US-11034704-B2 Muscarinic receptor agonists CHRM1, CHRM2, CHRM3 CYP11B1 612/4885CYP11B2 634/4885CHRM1 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.