SCHEMBL911562

SCHEMBL911562

c1ccc2c(O[C@@H]3C[C@H]4CCC[C@@H](C3)N4)nsc2c1

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 16/20 0.44
SLC6A2 P23975 12/20 0.44
SLC6A3 Q01959 10/20 0.44
KCNH2 Q12809 1/20 0.39
ACACB O00763 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
SCHEMBL911563 1.00 SLC6A4 (0.44) SLC6A4SLC6A2SLC6A3KCNH2ACACB
SCHEMBL911260 0.82 SLC6A4 (0.45) SLC6A4SLC6A2SLC6A3
SCHEMBL911262 0.82 SLC6A4 (0.45) SLC6A4SLC6A2SLC6A3
SCHEMBL910950 0.82 SLC6A4 (0.45) SLC6A4SLC6A2SLC6A3
SCHEMBL910949 0.82 SLC6A4 (0.45) SLC6A4SLC6A2SLC6A3
SCHEMBL1177928 0.76 SLC6A2 (0.52) SLC6A4SLC6A2SLC6A3KCNH2ACACB
Hydrochloric Acid SCHEMBL1178256 0.75 SLC6A2 (0.51) SLC6A4SLC6A2SLC6A3KCNH2ACACB
SCHEMBL911251 0.74 SLC6A4 (0.45) SLC6A4SLC6A2SLC6A3KCNH2
SCHEMBL911248 0.74 SLC6A4 (0.45) SLC6A4SLC6A2SLC6A3KCNH2
SCHEMBL632133 0.73 KDM4E (0.38) SLC6A4SLC6A2SLC6A3KCNH2ACACB

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-7868017-B2 9-azabicyclo[3.3.1]nonane derivatives N.V. ORGANON (NL) 2011-01-11 US disclosed
US-7868017-B2 9-azabicyclo[3.3.1]nonane derivatives N.V. ORGANON (NL) 2011-01-11 US disclosed
US-7868017-B2 9-azabicyclo[3.3.1]nonane derivatives N.V. ORGANON (NL) 2011-01-11 US disclosed
US-20070112019-A1 9-Azabicyclo[3.3.1]nonane derivatives N.V. ORGANON (NL) 2007-05-17 US disclosed
US-20070112019-A1 9-Azabicyclo[3.3.1]nonane derivatives N.V. ORGANON (NL) 2007-05-17 US disclosed
US-20070112019-A1 9-Azabicyclo[3.3.1]nonane derivatives N.V. ORGANON (NL) 2007-05-17 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-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.