SCHEMBL1029499

SCHEMBL1029499

CC(C)(C)OC(=O)N1[C@@H]2CC[C@H]1C[C@H](Oc1cc(Cl)cc(-c3ccccc3)n1)C2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 7/20 0.47
▸ CHRM2 P08172 1/20 0.42
▸ CHRM1 P11229 1/20 0.42
▸ CHRM3 P20309 1/20 0.42
▸ HTR3E A5X5Y0 1/20 0.41
▸ HTR3B O95264 1/20 0.41
▸ HTR3A P46098 1/20 0.41
▸ HTR3D Q70Z44 1/20 0.41
▸ HTR3C Q8WXA8 1/20 0.41
▸ CACNB4 O00305 3/20 0.40
▸ CACNA1A O00555 3/20 0.40
▸ CACNA1G O43497 3/20 0.40
▸ CACNG3 O60359 3/20 0.40
▸ CACNA1F O60840 3/20 0.40
▸ CACNA1H O95180 3/20 0.40
▸ CACNB3 P54284 3/20 0.40
▸ CACNA2D1 P54289 3/20 0.40
▸ CACNG7 P62955 3/20 0.40
▸ CACNA1B Q00975 3/20 0.40
▸ CACNA1D Q01668 3/20 0.40

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
SCHEMBL1029500 1.00 GPR119 (0.47) GPR119CHRM2CHRM1CHRM3HTR3E
SCHEMBL1029014 0.86 SLC6A2 (0.57) GPR119CHRM2CHRM1CHRM3HTR3E
SCHEMBL1029013 0.86 SLC6A2 (0.57) GPR119CHRM2CHRM1CHRM3HTR3E
SCHEMBL1029892 0.84 CHRM2 (0.48) GPR119CHRM2CHRM1CHRM3HTR3E
SCHEMBL1029893 0.84 CHRM2 (0.48) GPR119CHRM2CHRM1CHRM3HTR3E
SCHEMBL12094676 0.79 GPR119 (0.51) GPR119CHRM2CHRM1CHRM3KCNK3
SCHEMBL12094702 0.79 GPR119 (0.51) GPR119CHRM2CHRM1CHRM3KCNK3
SCHEMBL12094684 0.78 CHRM2 (0.45) GPR119CHRM2CHRM1CHRM3KCNK3
SCHEMBL12076859 0.77 GPR119 (0.52) GPR119CHRM2CHRM1CHRM3HTR3E
SCHEMBL12094616 0.77 GPR119 (0.52) GPR119CHRM2CHRM1CHRM3HTR3E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1957493-B1 8-AZABICYCLO[3.2.1]OCTANE DERIVATIVES USEFUL AS MONOAMINE REUPTAKE INHIBITORS ORGANON NV (NL) 2011-01-19 — — EP disclosed
US-7605170-B2 8-azabicyclo[3.2.1]octane derivatives N.V. ORGANON (NL) 2009-10-20 — — US disclosed
EP-1957493-A1 8-AZABICYCLO[3.2.1]OCTANE DERIVATIVES USEFUL AS MONOAMINE REUPTAKE INHIBITORS N.V. Organon (NL) 2008-08-20 — — EP disclosed
US-20070185156-A1 8-Azabicyclo[3.2.1]octane derivatives N.V. ORGANON (NL) 2007-08-09 — — US disclosed
WO-2007063071-A1 8-AZABICYCLO[3.2.1]OCTANE DERIVATIVES USEFUL AS MONOAMINE REUPTAKE INHIBITORS N.V. ORGANON (NL) 2007-06-07 — — 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-20070185156-A1 8-Azabicyclo[3.2.1]octane derivatives SLC22A8, SLCO1B3, SLCO1B1 GPR119 2412/4885CHRM2 1718/4885CHRM1 1961/4885

“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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