SCHEMBL15092041

SCHEMBL15092041

CC(C)(C)OC(=O)N1CC2CN(c3ccncc3)CC2C1

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 13/20 0.50
PDE10A Q9Y233 2/20 0.47
NR1H2 P55055 1/20 0.47
CHRM1 P11229 3/20 0.46
GRM1 Q13255 1/20 0.45

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
SCHEMBL30040816 1.00 GPR119 (0.50) GPR119PDE10ANR1H2CHRM1GRM1
SCHEMBL38663441 0.89 GPR119 (0.52) GPR119PDE10AGRM1
SCHEMBL10111733 0.86 GPR119 (0.67) GPR119PDE10ANR1H2
SCHEMBL15596306 0.86 GPR119 (0.67) GPR119PDE10ANR1H2
SCHEMBL27399965 0.84 GPR119 (0.67) GPR119PDE10ANR1H2
SCHEMBL20511076 0.84 GPR119 (0.67) GPR119PDE10ANR1H2
SCHEMBL652594 0.84 GPR119 (0.71) GPR119PDE10AGRM1
SCHEMBL652595 0.84 GPR119 (0.71) GPR119PDE10AGRM1
SCHEMBL19078501 0.84 GPR119 (0.50) GPR119NR1H2
SCHEMBL22523841 0.83 GPR119 (0.52) GPR119PDE10ANR1H2

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-8697888-B2 Substituted (1-(methylsulfonyl)azetidin-3-yl)(heterocycloalkyl)methanone analogs as antagonists of muscarinic acetylcholine M1 receptors VANDERBILT UNIVERSITY (US) 2014-04-15 US disclosed
US-20130178458-A1 SUBSTITUTED (1-(METHYLSULFONYL)AZETIDIN-3-YL)(HETEROCYCLOALKYL)METHANONE ANALOGS AS ANTAGONISTS OF MUSCARINIC ACETYLCHOLINE M1 RECEPTORS VANDERBILT UNIVERSITY (US) 2013-07-11 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-20130178458-A1 SUBSTITUTED (1-(METHYLSULFONYL)AZETIDIN-3-YL)(HETEROCYCLOALKYL)METHANONE ANALOGS AS ANTAGONISTS OF MUSCARINIC ACETYLCHOLINE M1 RECEPTORS CHRM1, CHRM5, CHRM3 GPR119 285/4885PDE10A 2687/4885NR1H2 766/4885

“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.