SCHEMBL911442

SCHEMBL911442

Cc1cccc(OC2CC3CCCC(C2)N3)c1C

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 17/20 0.51
SLC6A2 P23975 13/20 0.51
SLC6A3 Q01959 12/20 0.51
KCNH2 Q12809 1/20 0.39
PIM1 P11309 1/20 0.38
PIM2 Q9P1W9 1/20 0.38
CTSV O60911 2/20 0.38
CTSL P07711 2/20 0.38
CTSB P07858 2/20 0.38
CTSS P25774 2/20 0.38
CTSK P43235 2/20 0.38
CTSC P53634 2/20 0.38
CTSF Q9UBX1 2/20 0.38
CTSH P09668 1/20 0.38

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
SCHEMBL911661 1.00 SLC6A4 (0.51) SLC6A4SLC6A2SLC6A3KCNH2PIM1
SCHEMBL911441 1.00 SLC6A4 (0.51) SLC6A4SLC6A2SLC6A3KCNH2PIM1
SCHEMBL911662 0.85 SLC6A4 (0.49) SLC6A4SLC6A2SLC6A3KCNH2PIM1
SCHEMBL911902 0.85 SLC6A4 (0.49) SLC6A4SLC6A2SLC6A3
SCHEMBL911871 0.85 SLC6A4 (0.64) SLC6A4SLC6A2SLC6A3KCNH2PIM1
SCHEMBL914904 0.85 SLC6A4 (0.49) SLC6A4SLC6A2SLC6A3KCNH2PIM1
SCHEMBL911901 0.85 SLC6A4 (0.49) SLC6A4SLC6A2SLC6A3
SCHEMBL911872 0.85 SLC6A4 (0.64) SLC6A4SLC6A2SLC6A3KCNH2PIM1
SCHEMBL911663 0.85 SLC6A4 (0.49) SLC6A4SLC6A2SLC6A3KCNH2PIM1
SCHEMBL912043 0.82 SLC6A4 (0.47) SLC6A4SLC6A2SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7868017-B2 9-azabicyclo[3.3.1]nonane derivatives N.V. ORGANON (NL) 2011-01-11 US disclosed
EP-1934212-A1 9-AZABICYCLO [3 . 3 . 1]NONANE DERIVATIVES AS MONOAMINE REUPTAKE INHIBITORS N.V. Organon (NL) 2008-06-25 EP disclosed
US-20070112019-A1 9-Azabicyclo[3.3.1]nonane derivatives N.V. ORGANON (NL) 2007-05-17 US disclosed
WO-2007039563-A1 9-AZABICYCLO [3 . 3 . 1] NONANE DERIVATIVES AS MONOAMINE REUPTAKE INHIBITORS N.V. ORGANON (NL) 2007-04-12 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-20070112019-A1 9-Azabicyclo[3.3.1]nonane derivatives AZI2, TPMT, TET3 SLC6A4 1776/4885SLC6A2 1059/4885SLC6A3 339/4885

“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.