SCHEMBL20182932

SCHEMBL20182932

CCOC(=O)C1c2ccccc2CC(=O)N1C1CC12CC2

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
CHRM4 P08173 2/20 0.36
KCNH2 Q12809 2/20 0.36
MAPT P10636 2/20 0.35
ALDH1A1 P00352 2/20 0.35
HTT P42858 2/20 0.35
GRM7 Q14831 1/20 0.35
ACE P12821 1/20 0.35
NOTUM Q6P988 1/20 0.35
KDM4E B2RXH2 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
HSD17B10 Q99714 1/20 0.35
LMNA P02545 1/20 0.35
MAPK1 P28482 1/20 0.35

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
SCHEMBL19953669 0.79 MEN1 (0.42) MEN1KMT2AKCNH2MAPTALDH1A1
SCHEMBL20113096 0.77 GRM7 (0.55) MEN1KMT2ACHRM4KCNH2MAPT
SCHEMBL20166097 0.73 GRM7 (0.39) MEN1KMT2ACHRM4KCNH2MAPT
SCHEMBL11275259 0.69 KDM4E (0.42) MEN1KMT2AKCNH2ALDH1A1ACE
SCHEMBL1998760 0.68 HDAC4 (0.44) MEN1KMT2AMAPTALDH1A1HTT
SCHEMBL19953701 0.67 ACE (0.47) GRM7ACENOTUM
SCHEMBL19960826 0.67 ACE (0.47) GRM7ACENOTUM
SCHEMBL14879169 0.67 PRCP (0.51) KMT2AALDH1A1ACENOTUMKDM4E
SCHEMBL5897623 0.66 MEN1 (0.48) MEN1KMT2AMAPTALDH1A1NOTUM
SCHEMBL7344344 0.66 ACE (0.50) SIGMAR1MEN1KMT2AALDH1A1HTT

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-2018092921-A1 MGLUR7 AGONIST COMPOUNDS FOR TREATING MGLUR7- REGULATED DISEASES, DISORDERS, OR CONDITIONS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2018-05-24 WO disclosed