SCHEMBL18428958

SCHEMBL18428958

O=C(O)N1CCC(N(Cc2ccon2)C2CC2)CC1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.37
NPC1 O15118 3/20 0.34
ALDH1A1 P00352 3/20 0.34
RAB9A P51151 2/20 0.34
LMNA P02545 3/20 0.34
CNR2 P34972 1/20 0.33
GPR119 Q8TDV5 1/20 0.33
PKM P14618 1/20 0.33
L3MBTL3 Q96JM7 1/20 0.33
CHRM2 P08172 1/20 0.32
CHRM3 P20309 1/20 0.32

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
SCHEMBL22797901 0.82 CHRM4 (0.38) KDM4EALDH1A1CNR2L3MBTL3CHRM2
SCHEMBL18469984 0.77 SLC6A2 (0.38) KDM4ENPC1ALDH1A1RAB9A
SCHEMBL22798329 0.77 ALDH1A1 (0.33) KDM4EALDH1A1CNR2
SCHEMBL6630534 0.74 FNTA (0.39) KDM4EALDH1A1GPR119
Hydrochloric Acid SCHEMBL18429058 0.73 SLC6A4 (0.40) KDM4E
SCHEMBL4054057 0.73 SIRT6 (0.33)
SCHEMBL27564862 0.73 KDM4E (0.51) KDM4EALDH1A1CHRM3
SCHEMBL27544609 0.69 OPRM1 (0.47) KDM4EALDH1A1
SCHEMBL3981425 0.69 KMT2A (0.44) ALDH1A1
SCHEMBL18428965 0.66 L3MBTL3 (0.32) L3MBTL3

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 13 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

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 2872/4885NPC1 1935/4885ALDH1A1 1831/4885
US-20180022726-A1 MUSCARINIC AGONISTS CHRM1, CHRM2, CHRM3 KDM4E 2872/4885NPC1 1935/4885ALDH1A1 1831/4885
US-20190270718-A1 MUSCARINIC AGONISTS CHRM1, CHRM2, CHRM3 KDM4E 2872/4885NPC1 1935/4885ALDH1A1 1831/4885
US-10351545-B2 Muscarinic agonists CHRM1, CHRM2, CHRM3 KDM4E 2872/4885NPC1 1935/4885ALDH1A1 1831/4885
US-20170037025-A1 Muscarinic Agonists CHRM1, CHRM2, CHRM3 KDM4E 2872/4885NPC1 1935/4885ALDH1A1 1831/4885
US-20180155315-A1 MUSCARINIC AGONISTS CHRM1, CHRM2, CHRM3 KDM4E 2872/4885NPC1 1935/4885ALDH1A1 1831/4885
US-10167272-B2 Muscarinic agonists CHRM1, CHRM2, CHRM3 KDM4E 2872/4885NPC1 1935/4885ALDH1A1 1831/4885

“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.