SCHEMBL21545793

SCHEMBL21545793

COc1ccc(Cc2cc(C(=O)N[C@@H]3COCC[C@@H]3O)nc3c2OCCO3)cc1

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CHRM1 P11229 18/20 0.44
▸ KMT2A Q03164 1/20 0.43
▸ PDE2A O00408 1/20 0.42
▸ PDE11A Q9HCR9 1/20 0.42

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
SCHEMBL19932625 1.00 CHRM1 (0.44) CHRM1KMT2APDE2APDE11A
SCHEMBL21545734 1.00 CHRM1 (0.44) CHRM1KMT2APDE2APDE11A
SCHEMBL19932706 0.90 CHRM1 (0.47) CHRM1
SCHEMBL21545788 0.89 CHRM1 (0.46) CHRM1PDE2APDE11A
SCHEMBL19932672 0.89 CHRM1 (0.46) CHRM1PDE2APDE11A
SCHEMBL21545832 0.89 CHRM1 (0.46) CHRM1PDE2APDE11A
SCHEMBL21563005 0.88 CHRM1 (0.46) CHRM1PDE2APDE11A
SCHEMBL21545712 0.86 CHRM1 (0.44) CHRM1KMT2APDE2APDE11A
SCHEMBL21545743 0.86 CHRM1 (0.44) CHRM1KMT2APDE2APDE11A
SCHEMBL19932661 0.86 CHRM1 (0.44) CHRM1KMT2APDE2APDE11A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11040026-B2 Muscarinic M1 receptor positive allosteric modulators SUVEN LIFE SCIENCES LIMITED (IN) 2021-06-22 — — US claimed
US-11040026-B2 Muscarinic M1 receptor positive allosteric modulators SUVEN LIFE SCIENCES LIMITED (IN) 2021-06-22 — — US disclosed
EP-3507289-B1 MUSCARINIC M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS SUVEN LIFE SCIENCES LTD (IN) 2020-07-15 — — EP disclosed
US-20190343812-A1 MUSCARINIC M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS SUVEN LIFE SCIENCES LIMITED (IN) 2019-11-14 — — 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-11040026-B2 Muscarinic M1 receptor positive allosteric modulators CHRM1, CHRM2, CHRM3 CHRM1 1/4885KMT2A 2004/4885PDE2A 1330/4885
US-20190343812-A1 MUSCARINIC M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS CHRM1, CHRM2, CHRM3 CHRM1 1/4885KMT2A 2004/4885PDE2A 1330/4885

“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.

Send feedback