SCHEMBL7776209

SCHEMBL7776209

CC(C)(C)OC(=O)N1CCN(CC(O)COc2ccc(CC#N)cc2)CC1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.57
KMT2A Q03164 3/20 0.57
ABCB1 P08183 1/20 0.55
HTR2A P28223 1/20 0.53
MAPT P10636 1/20 0.51
POLB P06746 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
KDM4E B2RXH2 1/20 0.49
GLA P06280 1/20 0.49
USP2 O75604 1/20 0.49
TSHR P16473 1/20 0.49
GPR119 Q8TDV5 2/20 0.48
CACNA1G O43497 1/20 0.47
KCNH2 Q12809 1/20 0.47

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
SCHEMBL7776155 0.96 KMT2A (0.53) MEN1KMT2AABCB1HTR2AMAPT
SCHEMBL7388398 0.89 ABCB1 (0.57) MEN1KMT2AABCB1HTR2AMAPT
SCHEMBL5901095 0.85 KDM4E (0.62) MEN1KMT2AABCB1MAPTPOLB
SCHEMBL5749820 0.84 HTR2A (0.64) MEN1KMT2AABCB1HTR2AMAPT
SCHEMBL7776183 0.83 GPR119 (0.47) MEN1KMT2AABCB1HTR2AMAPT
SCHEMBL7769768 0.83 GPR119 (0.47) MEN1KMT2AABCB1HTR2AMAPT
SCHEMBL7776181 0.82 GPR119 (0.48) MEN1KMT2AABCB1HTR2AMAPT
SCHEMBL7389832 0.79 ABCB1 (0.56) MEN1KMT2AABCB1HTR2AMAPT
SCHEMBL23202714 0.77 ATF4 (0.62) MEN1KMT2AABCB1HTR2ACACNA1G
SCHEMBL21819438 0.77 ATF4 (0.62) MEN1KMT2AABCB1HTR2ACACNA1G

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0574906-B1 Piperazine and homopiperazine derivatives, pharmaceutical compositions containing them and process for preparing the same NISSHIN FLOUR MILLING CO (JP) 2001-08-22 EP disclosed
US-5439909-A 2-Substituted with amide or thioamide group; antioxidant for lipoproteins, antilipemic agents, anticholesterol agents ADIR ET COMPAGNIE (FR) 1995-08-08 US disclosed
US-5420132-A Antilipemic agents ADIR ET COMPAGNIE (FR) 1995-05-30 US disclosed
US-5380724-A Inhibitors of lipid peroxidation GYOGYSZERKUTATO INTEZET KFT (HU) 1995-01-10 US disclosed
EP-0574906-A2 Piperazine and homopiperazine derivatives, pharmaceutical compositions containing them and process for preparing the same NISSHIN FLOUR MILLING CO., LTD. (JP) 1993-12-22 EP disclosed