SCHEMBL5218486

SCHEMBL5218486

CC(=O)Oc1ccc(CC2NCOC2=O)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CACNA1G O43497 1/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
LMNA P02545 3/20 0.39
GLA P06280 1/20 0.38
SMN1; SMN2 Q16637 4/20 0.38
CYP2D6 P10635 3/20 0.38
ALDH1A1 P00352 3/20 0.38
MAPK1 P28482 2/20 0.38
HIF1A Q16665 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
SLC2A1 P11166 1/20 0.38
ESR1 P03372 1/20 0.38
PGR P06401 1/20 0.38
CHRM2 P08172 1/20 0.38
ADORA3 P0DMS8 1/20 0.38
AR P10275 1/20 0.38
CHRM1 P11229 1/20 0.38
SLC6A2 P23975 1/20 0.38

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
SCHEMBL15672146 0.77 LMNA (0.40) MEN1KMT2ALMNAGLAALDH1A1
SCHEMBL4408315 0.73 MMP1 (0.48) MEN1KMT2ALMNAGLASMN1; SMN2
SCHEMBL20977566 0.71 CACNA1G (0.39) CACNA1GKMT2AMAPTPKM
SCHEMBL11222246 0.70 LMNA (0.42) MEN1KMT2ALMNAGLAALDH1A1
SCHEMBL20977455 0.70 CACNA1G (0.43) CACNA1GESR1
SCHEMBL5918566 0.69 MAPT (0.60) MEN1KMT2AALDH1A1CYP2C9CYP3A4
SCHEMBL9132887 0.69 LMNA (0.47) MEN1KMT2ALMNASMN1; SMN2ALDH1A1
SCHEMBL4358923 0.69 GLA (0.45) MEN1KMT2ALMNAGLAALDH1A1
SCHEMBL25455638 0.69 CYP19A1 (0.42) MEN1KMT2AMAPK1CYP2C9CYP2C19
SCHEMBL20180622 0.68 CACNA1G (0.38) CACNA1GKMT2AMAPTPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1575900-A4 N-METHYL AMINO ACIDS UBIQUITOUS TECHNOLOGIES PTY LT (AU) 2007-02-21 EP disclosed
EP-1575900-A1 N-METHYL AMINO ACIDS UBIQUITOUS TECHNOLOGIES PTY LTD (AU) 2005-09-21 EP disclosed
WO-2004007427-A1 N-METHYL AMINO ACIDS UBIQUITOUS TECHNOLOGIES PTY LTD (AU) 2004-01-22 WO disclosed