SCHEMBL8023004

SCHEMBL8023004

ClCc1coc(C2CCNCC2)n1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
USP7 Q93009 2/20 0.36
NR1H4 Q96RI1 1/20 0.34
DYRK1A Q13627 6/20 0.33
GSK3B P49841 3/20 0.33
THRB P10828 1/20 0.33
HRH4 Q9H3N8 1/20 0.33
HRH3 Q9Y5N1 1/20 0.32
SLC18A3 Q16572 1/20 0.32
SIGMAR1 Q99720 1/20 0.32
BCHE P06276 1/20 0.31
ACHE P22303 1/20 0.31
PLG P00747 1/20 0.31
FAAH O00519 1/20 0.30

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
SCHEMBL249804 0.88 CCNE1 (0.31)
SCHEMBL5725170 0.83 ALDH1A1 (0.36)
SCHEMBL8175087 0.72 QDPR (0.39) DYRK1AFAAH
SCHEMBL18711979 0.71 USP7 (0.37) USP7NR1H4DYRK1AHRH4HRH3
SCHEMBL14243079 0.70 NR1H4 (0.37) USP7NR1H4DYRK1AGSK3BHRH4
Hydrochloric Acid SCHEMBL18689632 0.70 USP7 (0.36) USP7NR1H4DYRK1AHRH4HRH3
SCHEMBL411063 0.69 RET (0.32)
SCHEMBL19885770 0.69 CCNE1 (0.33)
SCHEMBL15133550 0.69 CCNE1 (0.33)
SCHEMBL14683656 0.68 USP7 (0.43) USP7NR1H4DYRK1AGSK3BHRH4

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
WO-2009123992-A1 OXYMETHYLENE ARYL COMPOUNDS AND USES THEREOF METABOLEX, INC. (US) 2009-10-08 WO disclosed
WO-2008083238-A2 HETEROCYCLIC RECEPTOR AGONISTS FOR THE TREATMENT OF DIABETES AND METABOLIC DISORDERS METABOLEX INC. (US) 2008-07-10 WO disclosed