SCHEMBL45921

SCHEMBL45921

O=C(CCn1ccnc1)OCCCCCCOC(=O)CCn1ccnc1

nearest known ligand 0.57

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
EGLN3 Q9H6Z9 1/20 0.57
TBXAS1 P24557 13/20 0.55
NOS1 P29475 1/20 0.48

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
SCHEMBL47383 0.98 EGLN3 (0.59) EGLN3TBXAS1
SCHEMBL15223347 0.95 EGLN3 (0.59) EGLN3TBXAS1
SCHEMBL47381 0.93 TBXAS1 (0.58) EGLN3TBXAS1
SCHEMBL45906 0.92 EGLN3 (0.53) EGLN3TBXAS1
SCHEMBL24386539 0.91 EGLN3 (0.51) EGLN3TBXAS1
SCHEMBL45905 0.89 TBXAS1 (0.54) EGLN3TBXAS1
SCHEMBL47375 0.89 TBXAS1 (0.53) EGLN3TBXAS1
SCHEMBL28481280 0.89 ALDH1A1 (0.49) EGLN3TBXAS1NOS1
SCHEMBL47755 0.87 EGLN3 (0.57) EGLN3TBXAS1
SCHEMBL46048 0.87 EGLN3 (0.57) EGLN3TBXAS1

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 6 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-8383721-B2 Polymerizable ionic liquid compositions 3M INNOVATIVE PROPERTIES COMPANY (US) 2013-02-26 US disclosed
WO-2011146326-A1 POLYMERIZABLE IONIC LIQUID COMPOSITIONS 3M INNOVATIVE PROPERTIES COMPANY (US) 2011-11-24 WO disclosed
US-20110288227-A1 POLYMERIZABLE IONIC LIQUID COMPOSITIONS 3M INNOVATIVE PROPERTIES COMPANY 2011-11-24 US disclosed
US-20110288227-A1 POLYMERIZABLE IONIC LIQUID COMPOSITIONS 3M INNOVATIVE PROPERTIES COMPANY 2011-11-24 US disclosed