SCHEMBL7356872

SCHEMBL7356872

COC(=O)[C@H]1NCCC1c1ccc2ccccc2c1

nearest known ligand 0.65

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 7/20 0.55
SLC6A3 Q01959 7/20 0.55
KDM1A O60341 1/20 0.43
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43

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
SCHEMBL2903921 1.00 SLC6A4 (0.55) SLC6A4SLC6A3KDM1AMAOAMAOB
SCHEMBL13125707 0.83 SLC6A4 (0.44) SLC6A4SLC6A3KDM1AMAOAMAOB
SCHEMBL3649072 0.83 SLC6A3 (0.49) SLC6A4SLC6A3
Hydrochloric Acid SCHEMBL8726217 0.82 SLC6A3 (0.48) SLC6A4SLC6A3
Hydrochloric Acid SCHEMBL8726215 0.82 SLC6A3 (0.48) SLC6A4SLC6A3
SCHEMBL13093193 0.80 SLC6A3 (0.55) SLC6A4SLC6A3
SCHEMBL13093030 0.80 SLC6A3 (0.55) SLC6A4SLC6A3
SCHEMBL5972686 0.79 SLC6A2 (0.39) SLC6A4SLC6A3
SCHEMBL13093209 0.79 TP53 (0.46) SLC6A4SLC6A3
SCHEMBL13093211 0.78 SLC6A3 (0.45) SLC6A4SLC6A3

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-6486193-B2 ANTIARTHRITIC AGENTS; ANTIINFLAMMATORY AGENTS AVENTIS PHARMACEUTICALS INC. 2002-11-26 US disclosed
US-20020037859-A1 3-substituted pyrrolidines useful as inhibitors of matrix metalloproteinases AVENTISUB INC. 2002-03-28 US disclosed
EP-1150951-A1 3-SUBSTITUTED PYRROLIDINES USEFUL AS INHIBITORS OF MATRIX METALLO-PROTEINASES Aventis Pharmaceuticals Inc. (US) 2001-11-07 EP disclosed
WO-2000040553-A1 3-SUBSTITUTED PYRROLIDINES USEFUL AS INHIBITORS OF MATRIX METALLO-PROTEINASES AVENTIS PHARMACEUTICALS INC. (US) 2000-07-13 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-20020037859-A1 3-substituted pyrrolidines useful as inhibitors of matrix metalloproteinases MMP3, MMP1, MMP9 SLC6A4 3995/4885SLC6A3 2953/4885KDM1A 570/4885

“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.