SCHEMBL23672944

SCHEMBL23672944

Cn1cc(-c2ccc(Cc3cc(C(=O)NC4CCOC(C)(C)C4)nc4ccsc34)cc2)cn1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CHRM1 P11229 7/20 0.51
▸ CCNC P24863 1/20 0.43
▸ CDK8 P49336 1/20 0.43
▸ CD38 P28907 1/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ GRM2 Q14416 1/20 0.39
▸ APAF1 O14727 1/20 0.38
▸ NPC1 O15118 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
SCHEMBL23673143 0.92 CHRM1 (0.58) CHRM1CD38RAB9AKMT2AAPAF1
SCHEMBL23673084 0.89 CHRM1 (0.64) CHRM1CCNCCDK8CD38
SCHEMBL23672658 0.88 CHRM1 (0.56) CHRM1RAB9AKMT2AAPAF1NPC1
SCHEMBL23672834 0.87 CD38 (0.41) CHRM1CD38RAB9AKMT2AAPAF1
SCHEMBL23673016 0.87 KMT2A (0.43) CHRM1RAB9AKMT2AAPAF1NPC1
SCHEMBL23672894 0.86 CHRM1 (0.48) CHRM1RAB9AKMT2AAPAF1NPC1
SCHEMBL23672615 0.84 CHRM1 (0.49) CHRM1CCNCCDK8CD38GRM2
SCHEMBL23672972 0.84 CHRM1 (0.49) CHRM1CCNCCDK8GRM2
SCHEMBL23672704 0.84 RAB9A (0.40) CHRM1RAB9AKMT2AAPAF1NPC1
SCHEMBL23672698 0.83 CHRM1 (0.48) CHRM1RAB9AKMT2AAPAF1NPC1

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 1/4885CCNC 3272/4885CDK8 1721/4885
US-11111251-B2 Positive allosteric modulators of the muscarinic acetylcholine receptor M1 CHRM1, CHRM2, CHRM4 CHRM1 1/4885CCNC 3272/4885CDK8 1721/4885

“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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