SCHEMBL18429032

SCHEMBL18429032

CC(=O)N(Cc1ccccc1)N1CCCCC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.50
CHRM4 P08173 1/20 0.50
CHRM5 P08912 1/20 0.50
CHRM1 P11229 1/20 0.50
CHRM3 P20309 1/20 0.50
TSPO P30536 1/20 0.45
DPP7 Q9UHL4 1/20 0.44
TDP1 Q9NUW8 3/20 0.43
KDM4E B2RXH2 3/20 0.43
LMNA P02545 1/20 0.43
HRH3 Q9Y5N1 1/20 0.42
NPC1 O15118 3/20 0.41
HTR6 P50406 1/20 0.41
ALDH1A1 P00352 1/20 0.41
RAB9A P51151 2/20 0.41
CA12 O43570 1/20 0.41
CA9 Q16790 1/20 0.41
CRHBP P24387 1/20 0.41
CRHR2 Q13324 1/20 0.41
CXCR4 P61073 1/20 0.41

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
SCHEMBL9690903 0.98 CHRM2 (0.51) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL6630975 0.83 TDP1 (0.43) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL6104697 0.79 MEN1 (0.52) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL7712884 0.78 AKT1 (0.44) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL8459141 0.74 HRH3 (0.51) HRH3NPC1ALDH1A1RAB9ACXCR4
Cyclohexane SCHEMBL9835197 0.74 ALOX5 (0.64) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL303045 0.74 SIGMAR1 (0.44) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL2389512 0.73 SIGMAR1 (0.47) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL3687461 0.72 KMT2A (0.44) CHRM2CHRM3LMNANPC1ALDH1A1
SCHEMBL4206481 0.72 SIGMAR1 (0.46) LMNANPC1ALDH1A1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
US-10351545-B2 Muscarinic agonists HEPTARES THERAPEUTICS LIMITED (GB) 2019-07-16 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
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 (6 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-20180022726-A1 MUSCARINIC AGONISTS CHRM1, CHRM2, CHRM3 CHRM2 2/4885CHRM4 4/4885CHRM5 5/4885
US-11773090-B2 Pharmaceutical compounds CHRM1, CHRM2, CHRM4 CHRM2 2/4885CHRM4 3/4885CHRM5 4/4885
US-10351545-B2 Muscarinic agonists CHRM1, CHRM2, CHRM3 CHRM2 2/4885CHRM4 4/4885CHRM5 5/4885
US-20210002271-A1 PHARMACEUTICAL COMPOUNDS CHRM1, CHRM2, CHRM4 CHRM2 2/4885CHRM4 3/4885CHRM5 4/4885
US-20170037025-A1 Muscarinic Agonists CHRM1, CHRM2, CHRM3 CHRM2 2/4885CHRM4 4/4885CHRM5 5/4885
US-10787447-B2 Pharmaceutical compounds CHRM1, CHRM2, CHRM4 CHRM2 2/4885CHRM4 3/4885CHRM5 4/4885

“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.