SCHEMBL19273155

SCHEMBL19273155

CN1CC=C([C@@H]2CCCN2Cc2ccccc2)CC1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ HTR6 P50406 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ MC4R P32245 1/20 0.39
▸ DRD2 P14416 1/20 0.38
▸ DRD4 P21917 1/20 0.38
▸ DRD3 P35462 1/20 0.38
▸ SIGMAR1 Q99720 1/20 0.38

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
SCHEMBL20909094 0.80 KDM4E (0.33) MAPT
SCHEMBL20908808 0.78 QDPR (0.30) —
SCHEMBL19273149 0.77 CHRNB2 (0.41) MAPT
SCHEMBL22130550 0.75 HSD11B1 (0.33) —
SCHEMBL22201130 0.74 CHRNB2 (0.53) DRD2DRD4DRD3
SCHEMBL2172790 0.74 CHRNB2 (0.53) DRD2DRD4DRD3
SCHEMBL28946589 0.73 HTR1A (0.45) HTR6DRD2DRD4DRD3SIGMAR1
SCHEMBL28946588 0.73 HTR1A (0.45) HTR6DRD2DRD4DRD3SIGMAR1
SCHEMBL19273238 0.72 — —
SCHEMBL20909095 0.72 MEN1 (0.32) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9926297-B2 Bicyclic AZA compounds as muscarinic M1 receptor and/or M4 receptor agonists HEPTARES THERAPEUTICS LIMITED (GB) 2018-03-27 — — US disclosed
US-20170240530-A1 BICYCLIC AZA COMPOUNDS AS MUSCARINIC M1 RECEPTOR AND/OR M4 RECEPTOR AGONISTS NXERA PHARMA UK LIMITED (GB) 2017-08-24 — — 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 (1 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-20170240530-A1 BICYCLIC AZA COMPOUNDS AS MUSCARINIC M1 RECEPTOR AND/OR M4 RECEPTOR AGONISTS CHRM1, CHRM2, CHRM4 HTR6 858/4885MAPT 3167/4885MC4R 106/4885

“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.

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