SCHEMBL496604

SCHEMBL496604

CC1C[C@H]2CN(C(=O)OC(C)(C)C)[C@H](CN)[C@H]2C1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.40
CHRM2 P08172 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33
HSD11B1 P28845 2/20 0.31
SRC P12931 4/20 0.30

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
SCHEMBL2446730 1.00 NR1H2 (0.40) NR1H2CHRM2CHRM1CHRM3HSD11B1
SCHEMBL10151427 1.00 NR1H2 (0.40) NR1H2CHRM2CHRM1CHRM3HSD11B1
SCHEMBL4074539 0.92 NR1H2 (0.43) NR1H2CHRM2CHRM1CHRM3HSD11B1
SCHEMBL2929834 0.92 NR1H2 (0.43) NR1H2CHRM2CHRM1CHRM3HSD11B1
SCHEMBL2926494 0.92 NR1H2 (0.43) NR1H2CHRM2CHRM1CHRM3HSD11B1
SCHEMBL1339459 0.92 NR1H2 (0.43) NR1H2CHRM2CHRM1CHRM3HSD11B1
SCHEMBL3415474 0.92 NR1H2 (0.43) NR1H2CHRM2CHRM1CHRM3HSD11B1
SCHEMBL3415478 0.92 NR1H2 (0.43) NR1H2CHRM2CHRM1CHRM3HSD11B1
SCHEMBL496608 0.89 NR1H2 (0.48) NR1H2CHRM2CHRM1CHRM3HSD11B1
SCHEMBL24909276 0.80 NR1H2 (0.53) NR1H2CHRM2CHRM1CHRM3HSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8106215-B2 3-aza-bicyclo[3.3.0]octane compounds ACTELION PHARMACEUTICALS LTD. (CH) 2012-01-31 US disclosed
EP-2164847-B1 3-AZA-BICYCLO[3.3.0]OCTANE COMPOUNDS ACTELION PHARMACEUTICALS LTD (CH) 2011-09-14 EP disclosed
US-20100184808-A1 3-AZA-BICYCLO[3.3.0]OCTANE COMPOUNDS ACTELION PHARMACEUTICALS LTD. (CH) 2010-07-22 US disclosed
EP-2164847-A1 3-AZA-BICYCLO[3.3.0]OCTANE COMPOUNDS Actelion Pharmaceuticals Ltd. (CH) 2010-03-24 EP disclosed
WO-2009004584-A1 3-AZA-BICYCLO[3.3.0]OCTANE COMPOUNDS ACTELION PHARMACEUTICALS LTD (CH) 2009-01-08 WO disclosed
WO-2009004584-A1 3-AZA-BICYCLO[3.3.0]OCTANE COMPOUNDS ACTELION PHARMACEUTICALS LTD (CH) 2009-01-08 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-20100184808-A1 3-AZA-BICYCLO[3.3.0]OCTANE COMPOUNDS HCRTR2, HCRTR1, OXTR NR1H2 237/4885CHRM2 270/4885CHRM1 208/4885

“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.