SCHEMBL4877080

SCHEMBL4877080

COCCNC1CCN(C(=O)O)CC1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.45
CHRM2 P08172 4/20 0.44
CHRM5 P08912 4/20 0.44
CHRM3 P20309 3/20 0.44
ALDH1A1 P00352 6/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
CHRM1 P11229 1/20 0.40
DRD2 P14416 1/20 0.40
ATM Q13315 2/20 0.40
TSHR P16473 1/20 0.40
USP2 O75604 1/20 0.39
SMYD3 Q9H7B4 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
TDP1 Q9NUW8 1/20 0.36
THRB P10828 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
MAPT P10636 1/20 0.36

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
SCHEMBL4503490 0.90 KDM4E (0.40) KDM4ECHRM2CHRM5CHRM3ALDH1A1
SCHEMBL28203429 0.88 ALDH1A1 (0.43) KDM4ECHRM2CHRM5CHRM3ALDH1A1
SCHEMBL23640028 0.87 EPHX2 (0.46) KDM4ECHRM2CHRM5CHRM3ALDH1A1
SCHEMBL18438090 0.82 EPHX2 (0.42) KDM4ECHRM2CHRM5CHRM3ALDH1A1
SCHEMBL5760447 0.81 TSHR (0.44) KDM4ECHRM2CHRM5CHRM3ALDH1A1
SCHEMBL1087862 0.80 EPHX1 (0.55) KDM4ECHRM2CHRM5CHRM3ALDH1A1
SCHEMBL28309712 0.80 ALDH1A1 (0.40) KDM4ECHRM2CHRM5CHRM3ALDH1A1
SCHEMBL2225265 0.79 KDM4E (0.40) KDM4ECHRM2CHRM5CHRM3ALDH1A1
SCHEMBL18440963 0.78 KDM4E (0.50) KDM4ECHRM2CHRM5CHRM3ALDH1A1
SCHEMBL5309693 0.78 KDM4E (0.47) KDM4ECHRM2CHRM5CHRM3ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3822262-B1 MUSCARINIC AGONISTS HEPTARES THERAPEUTICS LTD (GB) 2024-03-27 EP disclosed
US-11091456-B2 Muscarinic agonists HEPTARES THERAPEUTICS LIMITED (GB) 2021-08-17 US disclosed
EP-3822262-A1 MUSCARINIC AGONISTS Heptares Therapeutics Limited (GB) 2021-05-19 EP disclosed
EP-3331869-B1 MUSCARINIC AGONISTS HEPTARES THERAPEUTICS LTD (GB) 2020-12-23 EP disclosed
US-20190270718-A1 MUSCARINIC AGONISTS NXERA PHARMA UK LIMITED (GB) 2019-09-05 US disclosed
US-10351545-B2 Muscarinic agonists HEPTARES THERAPEUTICS LIMITED (GB) 2019-07-16 US disclosed
US-10167272-B2 Muscarinic agonists HEPTARES THERAPEUTICS LIMITED (GB) 2019-01-01 US disclosed
EP-3331869-A1 MUSCARINIC AGONISTS Heptares Therapeutics Limited (GB) 2018-06-13 EP disclosed
US-20180155315-A1 MUSCARINIC AGONISTS NXERA PHARMA UK LIMITED (GB) 2018-06-07 US disclosed
US-20180022726-A1 MUSCARINIC AGONISTS NXERA PHARMA UK LIMITED (GB) 2018-01-25 US disclosed
US-9758506-B2 Muscarinic agonists HEPTARES THERAPEUTICS LIMITED (GB) 2017-09-12 US disclosed
WO-2017021730-A1 MUSCARINIC AGONISTS HEPTARES THERAPEUTICS LIMITED (GB) 2017-02-09 WO disclosed
US-20170037025-A1 Muscarinic Agonists NXERA PHARMA UK LIMITED (GB) 2017-02-09 US disclosed
WO-2008016811-A2 AMINOPIPERIDINES AND REALTED COMPOUNDS NEUROGEN CORPORATION (US) 2008-02-07 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-11091456-B2 Muscarinic agonists CHRM1, CHRM2, CHRM3 KDM4E 2872/4885CHRM2 2/4885CHRM5 5/4885
US-20180022726-A1 MUSCARINIC AGONISTS CHRM1, CHRM2, CHRM3 KDM4E 2872/4885CHRM2 2/4885CHRM5 5/4885
US-20190270718-A1 MUSCARINIC AGONISTS CHRM1, CHRM2, CHRM3 KDM4E 2872/4885CHRM2 2/4885CHRM5 5/4885
US-10351545-B2 Muscarinic agonists CHRM1, CHRM2, CHRM3 KDM4E 2872/4885CHRM2 2/4885CHRM5 5/4885
US-20170037025-A1 Muscarinic Agonists CHRM1, CHRM2, CHRM3 KDM4E 2872/4885CHRM2 2/4885CHRM5 5/4885
US-20180155315-A1 MUSCARINIC AGONISTS CHRM1, CHRM2, CHRM3 KDM4E 2872/4885CHRM2 2/4885CHRM5 5/4885
US-10167272-B2 Muscarinic agonists CHRM1, CHRM2, CHRM3 KDM4E 2872/4885CHRM2 2/4885CHRM5 5/4885

“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.