SCHEMBL5318520

SCHEMBL5318520

CNC(=O)OC1C[C@@H](N)c2ccccc21

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 8/20 0.49
SLC6A3 Q01959 8/20 0.49
SLC6A4 P31645 5/20 0.48
BCHE P06276 4/20 0.39
KDM1A O60341 1/20 0.34
MAOB P27338 1/20 0.34
ACHE P22303 6/20 0.34
ALDH1A1 P00352 2/20 0.33
GAA P10253 2/20 0.33
PGR P06401 1/20 0.33
PTGS1 P23219 1/20 0.33
MAPK1 P28482 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TSHR P16473 1/20 0.33
POLB P06746 1/20 0.33

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
SCHEMBL5969950 0.80 SLC6A2 (0.59) SLC6A2SLC6A3SLC6A4KDM1AMAOB
SCHEMBL27922848 0.78 SLC6A2 (0.49) SLC6A2SLC6A3SLC6A4POLB
SCHEMBL2583594 0.75 BCHE (0.39) SLC6A2SLC6A3SLC6A4BCHEACHE
SCHEMBL12159639 0.75 BCHE (0.39) SLC6A2SLC6A3SLC6A4BCHEACHE
SCHEMBL30259179 0.72 SLC6A2 (0.61) SLC6A2SLC6A3SLC6A4KDM1AMAOB
SCHEMBL17729387 0.72 SLC6A2 (0.61) SLC6A2SLC6A3SLC6A4KDM1AMAOB
SCHEMBL11203577 0.72 IDO1 (0.51)
SCHEMBL9036022 0.71 EPHX2 (0.40) BCHEACHEALDH1A1GAAPGR
SCHEMBL20678609 0.70 BCHE (0.40) SLC6A2SLC6A3SLC6A4BCHEKDM1A
SCHEMBL20678737 0.70 BCHE (0.40) SLC6A2SLC6A3SLC6A4BCHEKDM1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007100583-A2 PROPARGYLATED AMINOINDANS, PROCESSES FOR PREPARATION, AND USES THEREOF TEVA PHARMACEUTICAL INDUSTRIES, LTD. (IL) 2007-09-07 WO claimed