SCHEMBL3228028

SCHEMBL3228028

Clc1ccc(COC2CN3CCC2CC3)cc1Cl

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 3/20 0.53
▸ CHRM1 P11229 5/20 0.50
▸ CHRM3 P20309 5/20 0.50
▸ CHRM5 P08912 4/20 0.50
▸ CHRM2 P08172 4/20 0.50
▸ CHRNA7 P36544 1/20 0.49
▸ DRD4 P21917 1/20 0.44
▸ IDO1 P14902 2/20 0.42
▸ CHRM4 P08173 1/20 0.42
▸ GLA P06280 1/20 0.41
▸ KCNA5 P22460 1/20 0.41
▸ SCN5A Q14524 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
SCHEMBL3228021 1.00 SIGMAR1 (0.53) SIGMAR1CHRM1CHRM3CHRM5CHRM2
SCHEMBL3210424 0.84 GLA (0.54) CHRM1CHRM3CHRM5CHRM2CHRNA7
SCHEMBL3210416 0.84 GLA (0.54) CHRM1CHRM3CHRM5CHRM2CHRNA7
SCHEMBL3216580 0.78 CYP1A2 (0.54) SIGMAR1CHRM1CHRM3CHRM5CHRM2
SCHEMBL3219330 0.78 MEN1 (0.51) CHRM1CHRM3CHRM5CHRM2CHRNA7
SCHEMBL3216566 0.78 CYP1A2 (0.54) SIGMAR1CHRM1CHRM3CHRM5CHRM2
SCHEMBL3219324 0.78 MEN1 (0.51) CHRM1CHRM3CHRM5CHRM2CHRNA7
SCHEMBL8988424 0.78 CHRNA7 (0.51) CHRM1CHRM3CHRM5CHRM2CHRNA7
SCHEMBL3218557 0.77 CHRNA7 (0.58) CHRM1CHRM3CHRM5CHRM2CHRNA7
SCHEMBL3206387 0.77 CHRNA7 (0.58) CHRM1CHRM3CHRM5CHRM2CHRNA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100056565-A1 Heterocyclic Derivatives as M3 Muscarinic Receptors ARGENTA DISCOVERY LIMITED (GB) 2010-03-04 — — US disclosed
EP-2121688-A1 HETEROCYCLIC DERIVATIVES AS M3 MUSCARINIC RECEPTORS Argenta Discovery Ltd (GB) 2009-11-25 — — EP disclosed
WO-2008099186-A1 HETEROCYCLIC DERIVATIVES AS M3 MUSCARINIC RECEPTORS ARGENTA DISCOVERY LIMITED (GB) 2008-08-21 — — WO 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-20100056565-A1 Heterocyclic Derivatives as M3 Muscarinic Receptors CHRM2, CHRM3, CHRM1 SIGMAR1 169/4885CHRM1 3/4885CHRM3 2/4885

“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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