SCHEMBL7583693

SCHEMBL7583693

COC(=O)O[C@H]1CNCCN1

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 4/20 0.32
CHRNA4 P43681 4/20 0.32
CHRNB4 P30926 2/20 0.32
CHRNA3 P32297 2/20 0.32
CHRNA7 P36544 1/20 0.32
MAPK1 P28482 1/20 0.31
OPRK1 P41145 1/20 0.31

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
SCHEMBL2572486 0.83
SCHEMBL29291158 0.80
SCHEMBL21004936 0.80 ALDH1A1 (0.40)
SCHEMBL7590352 0.80
SCHEMBL1351693 0.80 CHRM2 (0.33)
SCHEMBL27407047 0.79
Hydrochloric Acid SCHEMBL27835399 0.78 CHRM2 (0.33)
SCHEMBL31031091 0.78 CHRM2 (0.33)
Hydrochloric Acid SCHEMBL28060494 0.78 CHRM2 (0.33)
SCHEMBL19209920 0.78 SLC6A1 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0803502-B1 Process for the preparation of optically active piperazine-2-carboxylic acid derivatives LONZA AG (CH) 2002-06-26 EP disclosed
EP-0803502-A2 Process for the preparation of optically active piperazine-2-carboxylic acid derivatives LONZA AG (CH) 1997-10-29 EP disclosed