SCHEMBL5311142

SCHEMBL5311142

COC(C)OC(C)OCC(OC(=O)c1ccccn1)(OC(C)OC(C)OC)OC(C)OC(C)OC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.39
KDM4E B2RXH2 3/20 0.39
MAPT P10636 2/20 0.39
POLB P06746 1/20 0.39
KMT2A Q03164 1/20 0.38
ALDH1A1 P00352 6/20 0.37
NPSR1 Q6W5P4 1/20 0.37
HTT P42858 1/20 0.36
APP P05067 1/20 0.36
CES2 O00748 1/20 0.36
CES1 P23141 1/20 0.36
L3MBTL1 Q9Y468 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
GAA P10253 1/20 0.35
LMNA P02545 1/20 0.35
NAPRT Q6XQN6 1/20 0.35
P4HTM Q9NXG6 1/20 0.35
GSK3B P49841 1/20 0.35
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34

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
SCHEMBL5317688 0.84 KDM4E (0.43) PKMKDM4EMAPTPOLBKMT2A
SCHEMBL4349768 0.72 PKM (0.47) PKMKDM4EMAPTPOLBKMT2A
SCHEMBL5314748 0.71 CYP1A2 (0.37) KDM4EPOLBKMT2AALDH1A1SMN1; SMN2
Fluoride SCHEMBL28087422 0.70 ALDH1A1 (0.53) PKMKDM4EMAPTPOLBKMT2A
SCHEMBL3912008 0.70 APP (0.46) PKMKDM4EMAPTPOLBKMT2A
SCHEMBL5312198 0.68 CYP1A2 (0.43) KDM4EMAPTPOLBKMT2AALDH1A1
SCHEMBL2652708 0.68 ALDH1A1 (0.55) PKMKDM4EMAPTPOLBKMT2A
SCHEMBL29550139 0.68 ALDH1A1 (0.55) PKMKDM4EMAPTPOLBKMT2A
SCHEMBL3911548 0.68 APP (0.50) PKMKDM4EMAPTPOLBKMT2A
Fluoride SCHEMBL28136311 0.68 KDM4E (0.66) PKMKDM4EMAPTPOLBKMT2A

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-1840158-A1 METHOD FOR VULCANIZATION AND ADHESION OF RUBBER COMPOSITION WITH ARTICLE TO BE ADHERED BEING MADE OF BRASS OR PLATED WITH BRASS, REINFORCING MATERIAL FOR RUBBER ARTICLE, RUBBER-REINFORCING MATERIAL COMPOSITE, AND PNEUMATIC TIRE Bridgestone Corporation (JP) 2007-10-03 EP disclosed