SCHEMBL47755

SCHEMBL47755

O=C(CCn1ccnc1)OCCOCCOCCOCCOC(=O)CCn1ccnc1

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EGLN3 Q9H6Z9 1/20 0.57
TBXAS1 P24557 14/20 0.48
ALDH1A1 P00352 3/20 0.47
KDM4E B2RXH2 1/20 0.46
MEN1 O00255 1/20 0.46
LMNA P02545 1/20 0.46
KMT2A Q03164 1/20 0.46
MAPK1 P28482 1/20 0.44

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
SCHEMBL22490375 0.93 TBXAS1 (0.52) EGLN3TBXAS1ALDH1A1KDM4ELMNA
SCHEMBL22271403 0.93 EGLN3 (0.50) EGLN3TBXAS1ALDH1A1KDM4E
SCHEMBL22260976 0.91 TBXAS1 (0.53) EGLN3TBXAS1ALDH1A1KDM4ELMNA
SCHEMBL15223347 0.89 EGLN3 (0.59) EGLN3TBXAS1MEN1LMNAKMT2A
SCHEMBL47383 0.89 EGLN3 (0.59) EGLN3TBXAS1KDM4EMEN1LMNA
SCHEMBL46048 0.87 EGLN3 (0.57) EGLN3TBXAS1ALDH1A1MEN1LMNA
SCHEMBL45921 0.87 EGLN3 (0.57) EGLN3TBXAS1
SCHEMBL27782849 0.86 EGLN3 (0.56) EGLN3TBXAS1ALDH1A1KDM4E
SCHEMBL47371 0.84 EGLN3 (0.50) EGLN3TBXAS1ALDH1A1MEN1LMNA
SCHEMBL45906 0.83 EGLN3 (0.53) EGLN3TBXAS1KDM4EMEN1LMNA

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-2571908-B1 POLYMERIZABLE IONIC LIQUID COMPOSITIONS 3M INNOVATIVE PROPERTIES CO (US) 2017-04-26 EP disclosed
US-8383721-B2 Polymerizable ionic liquid compositions 3M INNOVATIVE PROPERTIES COMPANY (US) 2013-02-26 US disclosed
US-20110288227-A1 POLYMERIZABLE IONIC LIQUID COMPOSITIONS 3M INNOVATIVE PROPERTIES COMPANY 2011-11-24 US disclosed