SCHEMBL6864558

SCHEMBL6864558

CCOC(=O)OC1(OC(=O)OCC)COC2(CC(C)(C)N(OC(C)c3ccc(OCC4CO4)cc3)C(C)(C)C2)OC1

nearest known ligand 0.32

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.32
TP53 P04637 2/20 0.32
HPGD P15428 2/20 0.32
TSHR P16473 2/20 0.32
ALDH1A1 P00352 2/20 0.32
PKM P14618 2/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
CYP1A2 P05177 1/20 0.32
PPARG P37231 1/20 0.32
HIF1A Q16665 1/20 0.32
LMNA P02545 1/20 0.32
GAA P10253 1/20 0.32
ACACB O00763 5/20 0.32
FFAR1 O14842 1/20 0.31
GRM2 Q14416 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL6872742 0.94
SCHEMBL975990 0.88 MAPT (0.35) MAPTTP53HPGDTSHRALDH1A1
SCHEMBL6872267 0.85 PKM (0.35) MAPTTP53HPGDTSHRALDH1A1
SCHEMBL6865025 0.85 TDP1 (0.36) MAPTTP53HPGDTSHRALDH1A1
SCHEMBL6874267 0.84 TDP1 (0.36) MAPTTP53HPGDTSHRALDH1A1
SCHEMBL12922174 0.84 ALDH1A1 (0.39) MAPTTP53HPGDTSHRALDH1A1
SCHEMBL974405 0.84 ALDH1A1 (0.39) MAPTTP53HPGDTSHRALDH1A1
SCHEMBL975816 0.83 GRM2 (0.34) MAPTTP53HPGDTSHRALDH1A1
SCHEMBL977824 0.83 TP53 (0.37) MAPTTP53HPGDTSHRALDH1A1
SCHEMBL974683 0.83 TP53 (0.37) MAPTTP53HPGDTSHRALDH1A1

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
EP-1341763-B1 N-ALKOXY-4,4-DIOXY-POLYALKYL-PIPERIDINE COMPOUNDS, WITH GLYCIDYL OR ALKYLCARBONYL GROUPS AS FUNCTIONAL INITIATORS FOR CONTROLLED RADICAL POLYMERIZATION CIBA SC HOLDING AG (CH) 2004-06-16 EP claimed