SCHEMBL4226010

SCHEMBL4226010

CN1C2C=CC1CC(Oc1ccc(Cl)c(F)c1)C2

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 2/20 0.45
PROKR1 Q8TCW9 2/20 0.45
SLC6A2 P23975 3/20 0.39
SLC6A3 Q01959 3/20 0.39
SLC6A4 P31645 3/20 0.39
PTGS1 P23219 1/20 0.39
PTGS2 P35354 1/20 0.39
ATF4 P18848 1/20 0.36
CHRNA3 P32297 1/20 0.36
GRIN1 Q05586 1/20 0.36
GRIN2B Q13224 1/20 0.36
SCN9A Q15858 2/20 0.35
PPARG P37231 1/20 0.34
PPARA Q07869 1/20 0.34

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
SCHEMBL4226008 1.00 FPR2 (0.45) FPR2PROKR1SLC6A2SLC6A3SLC6A4
Hydrochloric Acid SCHEMBL4226126 0.99 FPR2 (0.44) FPR2PROKR1SLC6A2SLC6A3SLC6A4
SCHEMBL4217635 0.89 SLC6A2 (0.39) FPR2PROKR1SLC6A2SLC6A3SLC6A4
SCHEMBL4217638 0.89 SLC6A2 (0.39) FPR2PROKR1SLC6A2SLC6A3SLC6A4
Hydrochloric Acid SCHEMBL4216475 0.87 SLC6A2 (0.38) FPR2PROKR1SLC6A2SLC6A3SLC6A4
SCHEMBL4215952 0.87 SLC6A2 (0.53) FPR2PROKR1SLC6A2SLC6A3SLC6A4
SCHEMBL4213275 0.87 SLC6A2 (0.53) FPR2PROKR1SLC6A2SLC6A3SLC6A4
Hydrochloric Acid SCHEMBL4209491 0.85 SLC6A2 (0.51) FPR2PROKR1SLC6A2SLC6A3SLC6A4
SCHEMBL1177444 0.83 SLC6A3 (0.55) FPR2PROKR1SLC6A2SLC6A3SLC6A4
SCHEMBL1177443 0.83 SLC6A3 (0.55) FPR2PROKR1SLC6A2SLC6A3SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7638532-B2 3-aryloxy-8-aza-bicyclo[3.2.1]oct-6-ene derivatives and their use as monoamine neurotransmitter re-uptake inhibitors NEUROSEARCH A/S (DK) 2009-12-29 US claimed
US-20090030035-A1 3-Aryloxy-8-aza-bicyclo[3.2.1]]oct-6-ene derivatives and their use as monoamine neurotransmitter re-uptake inhibitors NEUROSEARCH A/S (DK) 2009-01-29 US claimed
EP-1896468-A1 3 -ARYLOXY- 8 -AZA-BICYCLO [3.2.1.] OCT- 6- ENE DERIVATIVES AND THEIR USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS NEUROSEARCH A/S (DK) 2008-03-12 EP claimed
WO-2006131525-A1 3 -ARYLOXY- 8 -AZA-BICYCLO [3.2.1.] OCT- 6- ENE DERIVATIVES AND THEIR USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS NEUROSEARCH A/S (DK) 2006-12-14 WO claimed
US-7638532-B2 3-aryloxy-8-aza-bicyclo[3.2.1]oct-6-ene derivatives and their use as monoamine neurotransmitter re-uptake inhibitors NEUROSEARCH A/S (DK) 2009-12-29 US disclosed
US-20090030035-A1 3-Aryloxy-8-aza-bicyclo[3.2.1]]oct-6-ene derivatives and their use as monoamine neurotransmitter re-uptake inhibitors NEUROSEARCH A/S (DK) 2009-01-29 US disclosed
EP-1896468-A1 3 -ARYLOXY- 8 -AZA-BICYCLO [3.2.1.] OCT- 6- ENE DERIVATIVES AND THEIR USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS NEUROSEARCH A/S (DK) 2008-03-12 EP disclosed
WO-2006131525-A1 3 -ARYLOXY- 8 -AZA-BICYCLO [3.2.1.] OCT- 6- ENE DERIVATIVES AND THEIR USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS NEUROSEARCH A/S (DK) 2006-12-14 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-20090030035-A1 3-Aryloxy-8-aza-bicyclo[3.2.1]]oct-6-ene derivatives and their use as monoamine neurotransmitter re-uptake inhibitors SLC18A2, SLC6A2, SLC18A3 FPR2 3266/4885PROKR1 3908/4885SLC6A2 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.