SCHEMBL23672591

SCHEMBL23672591

Cn1cc(-c2ccc(Oc3cc(C(=O)NC4CC[C@H]4O)nc4ccsc34)c(F)c2)cn1

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CHRM1 P11229 10/20 0.42
▸ MARK3 P27448 4/20 0.38
▸ USP30 Q70CQ3 1/20 0.37
▸ TTK P33981 1/20 0.37
▸ GSK3B P49841 2/20 0.36
▸ DYRK1A Q13627 2/20 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
SCHEMBL23673023 0.95 CHRM1 (0.47) CHRM1MARK3GSK3BDYRK1A
SCHEMBL23672965 0.95 CHRM1 (0.47) CHRM1MARK3GSK3BDYRK1A
SCHEMBL23672732 0.95 CHRM1 (0.47) CHRM1MARK3GSK3BDYRK1A
SCHEMBL23672846 0.91 CHRM1 (0.52) CHRM1
SCHEMBL23672582 0.91 CHRM1 (0.49) CHRM1
SCHEMBL23673076 0.88 AXL (0.40) CHRM1GSK3BDYRK1A
SCHEMBL23672950 0.87 CHRM1 (0.46) CHRM1USP30GSK3BDYRK1A
SCHEMBL23672940 0.85 CHRM1 (0.51) CHRM1MARK3
SCHEMBL23672598 0.84 CHRM1 (0.42) CHRM1
SCHEMBL23672782 0.81 CHRM1 (0.54) CHRM1MARK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11111251-B2 Positive allosteric modulators of the muscarinic acetylcholine receptor M1 VANDERBILT UNIVERSITY (US) 2021-09-07 — — US claimed
US-20210230180-A1 POSITIVE ALLOSTERIC MODULATORS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M1 VANDERBILT UNIVERSITY 2021-07-29 — — US claimed
EP-3416639-B1 POSITIVE ALLOSTERIC MODULATORS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M1 UNIV VANDERBILT (US) 2022-06-08 — — EP disclosed
US-11111251-B2 Positive allosteric modulators of the muscarinic acetylcholine receptor M1 VANDERBILT UNIVERSITY (US) 2021-09-07 — — US disclosed
US-20210230180-A1 POSITIVE ALLOSTERIC MODULATORS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M1 VANDERBILT UNIVERSITY 2021-07-29 — — 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 (2 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-20210230180-A1 POSITIVE ALLOSTERIC MODULATORS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M1 CHRM1, CHRM2, CHRM4 CHRM1 1/4885MARK3 490/4885USP30 1581/4885
US-11111251-B2 Positive allosteric modulators of the muscarinic acetylcholine receptor M1 CHRM1, CHRM2, CHRM4 CHRM1 1/4885MARK3 490/4885USP30 1581/4885

“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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