SCHEMBL19291383

SCHEMBL19291383

CC(C)CCOc1cccc(C(O)CCNOCCCOc2cccc(C(O)CCN)c2)c1

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 2/20 0.38
GALR3 O60755 1/20 0.38
HSP90AA1 P07900 1/20 0.38
NR1H4 Q96RI1 1/20 0.38

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
SCHEMBL29818907 0.88 AOC3 (0.46) AOC3GALR3HSP90AA1NR1H4
SCHEMBL2207386 0.88 AOC3 (0.46) AOC3GALR3HSP90AA1NR1H4
SCHEMBL25818187 0.82 AOC3 (0.50) AOC3GALR3HSP90AA1NR1H4
SCHEMBL25818192 0.81 KDM4E (0.46) AOC3GALR3HSP90AA1NR1H4
SCHEMBL29818798 0.80 AOC3 (0.46) AOC3
SCHEMBL2207065 0.80 AOC3 (0.46) AOC3
SCHEMBL19291914 0.80 AOC3 (0.46) AOC3
SCHEMBL16084812 0.78 LTB4R (0.52)
SCHEMBL15150956 0.77 AOC3 (0.43) AOC3
SCHEMBL2207435 0.77 CYSLTR2 (0.56)

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-3210966-A1 ALKOXYPHENYLPROPYLAMINES FOR THE TREATMENT OF AGE-RELATED MACULAR DEGENERATION Acucela, Inc. (US) 2017-08-30 EP disclosed