SCHEMBL15391245

SCHEMBL15391245

CN(C)c1c(CC(=O)ON2C(=O)CCC2=O)c2ccccc2oc1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.43
PSMB8 P28062 2/20 0.43
PSMB5 P28074 1/20 0.43
MAPT P10636 1/20 0.41
KMT2A Q03164 6/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
BRAF P15056 4/20 0.37
ALDH1A1 P00352 4/20 0.36
MEN1 O00255 4/20 0.36
LMNA P02545 3/20 0.36
TP53 P04637 2/20 0.36
TSHR P16473 2/20 0.36
MAPK1 P28482 2/20 0.36
ABCB11 O95342 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
NQO1 P15559 1/20 0.36

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
SCHEMBL429446 0.79 GAA (0.52) GAAMAPTKMT2ASMN1; SMN2NPC1
SCHEMBL17941700 0.73 KDM4E (0.58) GAAPSMB8PSMB5MAPTKMT2A
SCHEMBL2547365 0.72 ALDH1A1 (0.46) GAAPSMB8PSMB5MAPTKMT2A
SCHEMBL29579782 0.70 PSMB8 (0.45) GAAPSMB8PSMB5MAPTKMT2A
SCHEMBL22030047 0.68 PSMB8 (0.54) GAAPSMB8PSMB5MAPTKMT2A
SCHEMBL29385493 0.68 KDM4E (0.57) GAAPSMB8PSMB5MAPTSMN1; SMN2
SCHEMBL593432 0.68 KDM4E (0.57) GAAPSMB8PSMB5MAPTSMN1; SMN2
SCHEMBL20048310 0.68 ALDH1A1 (0.58) GAAMAPTKMT2ARAB9AALDH1A1
SCHEMBL2528490 0.67 SRC (0.53) GAAPSMB8PSMB5MAPTKMT2A
SCHEMBL29577443 0.67 SRC (0.53) GAAPSMB8PSMB5MAPTKMT2A

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-2850664-A2 POLYMER SHEET NovoPolymers N.V. (BE) 2015-03-25 EP disclosed
WO-2013171275-A2 POLYMER SHEET NOVOPOLYMERS N.V. (BE) 2013-11-21 WO disclosed