SCHEMBL12812223

SCHEMBL12812223

C=C(CN)N(C)Cc1cccc(-c2ccc(N3CCN(c4cccnc4)CC3)nc2)c1

nearest known ligand 0.51

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ AOC3 Q16853 20/20 0.51

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
SCHEMBL11360425 0.89 AOC3 (0.65) AOC3
SCHEMBL11364039 0.80 AOC3 (0.67) AOC3
SCHEMBL11362066 0.79 AOC3 (0.75) AOC3
Hydrochloric Acid SCHEMBL10319243 0.78 AOC3 (0.75) AOC3
SCHEMBL12812550 0.77 AOC3 (0.76) AOC3
SCHEMBL11356565 0.77 AOC3 (0.48) AOC3
SCHEMBL12814253 0.76 AOC3 (0.52) AOC3
SCHEMBL11364473 0.76 AOC3 (0.74) AOC3
SCHEMBL12812220 0.76 AOC3 (0.77) AOC3
SCHEMBL11361345 0.76 AOC3 (0.69) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011034078-A1 GLYCINE COMPOUND アステラス製薬株式会社 (JP) 2011-03-24 — — WO disclosed
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