SCHEMBL14410734

SCHEMBL14410734

CC(C)(C)OC(=O)N1C2CNC[C@@H]1C2

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.59
CHRM1 P11229 1/20 0.59
CHRM3 P20309 1/20 0.59
PREP P48147 4/20 0.42
NR1H2 P55055 1/20 0.39
HSD11B1 P28845 2/20 0.39
USP2 O75604 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
GPR119 Q8TDV5 2/20 0.36
CHRNB2 P17787 1/20 0.36
CHRNA4 P43681 1/20 0.36
HPGD P15428 1/20 0.35
EPHX2 P34913 1/20 0.35

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
SCHEMBL402018 1.00 CHRM2 (0.59) CHRM2CHRM1CHRM3PREPNR1H2
SCHEMBL24762766 1.00 CHRM2 (0.59) CHRM2CHRM1CHRM3PREPNR1H2
SCHEMBL3935909 1.00 CHRM2 (0.59) CHRM2CHRM1CHRM3PREPNR1H2
Hydrochloric Acid SCHEMBL30005366 0.98 CHRM2 (0.57) CHRM2CHRM1CHRM3PREPNR1H2
SCHEMBL2267993 0.89 CHRM2 (0.64) CHRM2CHRM1CHRM3PREPHSD11B1
SCHEMBL22569401 0.89 CHRM2 (0.64) CHRM2CHRM1CHRM3PREPHSD11B1
SCHEMBL178638 0.89 CHRM2 (0.64) CHRM2CHRM1CHRM3PREPHSD11B1
SCHEMBL21219895 0.89 CHRM2 (0.64) CHRM2CHRM1CHRM3PREPHSD11B1
SCHEMBL23807724 0.89 CHRM2 (0.64) CHRM2CHRM1CHRM3PREPHSD11B1
SCHEMBL30853292 0.89 CHRM2 (0.51) CHRM2CHRM1CHRM3PREPNR1H2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070225492-A1 3,6-Diazabicyclo[3.1.1]Heptane Derivatives with Analgesic Activity UNIVERSITA' DEGLI STUDI DI MILANO (IT) 2007-09-27 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-20070225492-A1 3,6-Diazabicyclo[3.1.1]Heptane Derivatives with Analgesic Activity OPRK1, OPRM1, OPRD1 CHRM2 251/4885CHRM1 60/4885CHRM3 219/4885

“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.