SCHEMBL12812673

SCHEMBL12812673

CCOC(=O)/C=C/c1cnc(N2CCN(c3ncc(-c4cccc(CN(C)C(=O)CNC(=O)OC(C)(C)C)c4)cn3)CC2)c(Cl)c1

nearest known ligand 0.67

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ AOC3 Q16853 20/20 0.67

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
SCHEMBL12812541 0.94 AOC3 (0.76) AOC3
SCHEMBL11356301 0.93 AOC3 (0.68) AOC3
SCHEMBL11356100 0.92 AOC3 (0.57) AOC3
SCHEMBL11358855 0.90 AOC3 (0.65) AOC3
SCHEMBL11361442 0.90 AOC3 (0.71) AOC3
SCHEMBL11359183 0.89 AOC3 (0.54) AOC3
SCHEMBL11361362 0.88 AOC3 (0.64) AOC3
SCHEMBL10318034 0.88 AOC3 (0.76) AOC3
SCHEMBL10318046 0.88 AOC3 (0.76) AOC3
SCHEMBL11361433 0.86 AOC3 (0.61) AOC3

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
US-8802679-B2 Glycine compound ASTELLAS PHARMA INC. (JP) 2014-08-12 — — US disclosed
US-8802679-B2 Glycine compound ASTELLAS PHARMA INC. (JP) 2014-08-12 — — US disclosed
WO-2011034078-A1 GLYCINE COMPOUND アステラス製薬株式会社 (JP) 2011-03-24 — — WO disclosed
Send feedback