SCHEMBL16210802

SCHEMBL16210802

CC(C)(C)OC(=O)C(=O)N1CCC[C@H](N2CCC(C(=O)O)CC2)CC1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.49
HPGD P15428 1/20 0.43
LMNA P02545 1/20 0.40
CHRM1 P11229 2/20 0.40
ALDH1A1 P00352 2/20 0.39
L3MBTL3 Q96JM7 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
MAPT P10636 2/20 0.36
RECQL P46063 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
HRH3 Q9Y5N1 1/20 0.35
HCAR1 Q9BXC0 1/20 0.35

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
SCHEMBL14978796 0.87 HPGD (0.58) HSD17B10HPGDLMNACHRM1ALDH1A1
SCHEMBL14978807 0.87 HPGD (0.58) HSD17B10HPGDLMNACHRM1ALDH1A1
SCHEMBL16210908 0.87 HPGD (0.58) HSD17B10HPGDLMNACHRM1ALDH1A1
SCHEMBL15487760 0.81 HPGD (0.56) HSD17B10HPGDLMNACHRM1SMN1; SMN2
SCHEMBL27912529 0.78 ALDH1A1 (0.48) HSD17B10HPGDALDH1A1SMN1; SMN2MAPT
SCHEMBL15050742 0.78 ALDH1A1 (0.48) HSD17B10HPGDALDH1A1SMN1; SMN2MAPT
SCHEMBL16217915 0.77 CHRM1 (0.52) HSD17B10HPGDLMNACHRM1ALDH1A1
SCHEMBL5425897 0.75 HPGD (0.68) HSD17B10HPGDLMNAALDH1A1SMN1; SMN2
SCHEMBL14964905 0.75 CHRM1 (0.68) CHRM1ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL14978797 0.74 HPGD (0.56) HSD17B10HPGDCHRM1ALDH1A1SMN1; 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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11793817-B2 Muscarinic M1 receptor agonists HEPTARES THERAPEUTICS LIMITED (GB) 2023-10-24 US disclosed
US-20210353637-A1 MUSCARINIC M1 RECEPTOR AGONISTS NXERA PHARMA UK LIMITED (GB) 2021-11-18 US disclosed
US-10973832-B2 Muscarinic M1 receptor agonists HEPTARES THERAPEUTICS LIMITED (GB) 2021-04-13 US disclosed
US-20200253982-A1 MUSCARINIC M1 RECEPTOR AGONISTS NXERA PHARMA UK LIMITED (GB) 2020-08-13 US disclosed
US-10413553-B2 Muscarinic M1 receptor agonists HEPTARES THERAPEUTICS LIMITED (GB) 2019-09-17 US disclosed
US-20180153900-A1 MUSCARINIC M1 RECEPTOR AGONISTS NXERA PHARMA UK LIMITED (GB) 2018-06-07 US disclosed
US-9907805-B2 Muscarinic M1 receptor agonists HEPTARES THERAPEUTICS LIMITED (GB) 2018-03-06 US disclosed
US-20170157139-A1 MUSCARINIC M1 RECEPTOR AGONISTS NXERA PHARMA UK LIMITED (GB) 2017-06-08 US disclosed
US-9573929-B2 Muscarinic M1 receptor agonists HEPTARES THERAPEUTICS LIMITED (GB) 2017-02-21 US disclosed
US-20160068508-A1 Muscarinic M1 Receptor Agonists NXERA PHARMA UK LIMITED (GB) 2016-03-10 US disclosed
US-9187451-B2 Muscarinic M1 receptor agonists HEPTARES THERAPEUTICS LIMITED (GB) 2015-11-17 US disclosed
US-20140329803-A1 MUSCARINIC M1 RECEPTOR AGONISTS NXERA PHARMA UK LIMITED (GB) 2014-11-06 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 (9 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-20140329803-A1 MUSCARINIC M1 RECEPTOR AGONISTS CHRM1, CHRM2, CHRM3 HSD17B10 3710/4885HPGD 2584/4885LMNA 2580/4885
US-20180153900-A1 MUSCARINIC M1 RECEPTOR AGONISTS CHRM1, CHRM2, CHRM3 HSD17B10 3710/4885HPGD 2584/4885LMNA 2580/4885
US-20160068508-A1 Muscarinic M1 Receptor Agonists CHRM1, CHRM2, CHRM3 HSD17B10 3710/4885HPGD 2584/4885LMNA 2580/4885
US-20200253982-A1 MUSCARINIC M1 RECEPTOR AGONISTS CHRM1, CHRM2, CHRM3 HSD17B10 3710/4885HPGD 2584/4885LMNA 2580/4885
US-20210353637-A1 MUSCARINIC M1 RECEPTOR AGONISTS CHRM1, CHRM2, CHRM3 HSD17B10 3710/4885HPGD 2584/4885LMNA 2580/4885
US-20170157139-A1 MUSCARINIC M1 RECEPTOR AGONISTS CHRM1, CHRM2, CHRM3 HSD17B10 3710/4885HPGD 2584/4885LMNA 2580/4885
US-10973832-B2 Muscarinic M1 receptor agonists CHRM1, CHRM2, CHRM3 HSD17B10 3710/4885HPGD 2584/4885LMNA 2580/4885
US-10413553-B2 Muscarinic M1 receptor agonists CHRM1, CHRM2, CHRM3 HSD17B10 3710/4885HPGD 2584/4885LMNA 2580/4885
US-11793817-B2 Muscarinic M1 receptor agonists CHRM1, CHRM2, CHRM3 HSD17B10 3710/4885HPGD 2584/4885LMNA 2580/4885

“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.