SCHEMBL12814199

SCHEMBL12814199

C=C(CN)N(C)Cc1cccc(-c2ccc(CN3CCC(O)CC3)cc2)c1

nearest known ligand 0.51

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ AOC3 Q16853 19/20 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
SCHEMBL12812572 0.91 AOC3 (0.46) AOC3
SCHEMBL12814079 0.88 CYP2D6 (0.53) AOC3
SCHEMBL11365217 0.88 AOC3 (0.66) AOC3
SCHEMBL12812553 0.82 KMT2A (0.54) AOC3
SCHEMBL11365311 0.82 AOC3 (0.61) AOC3
SCHEMBL19496744 0.79 AOC3 (0.64) AOC3
SCHEMBL11365260 0.78 AOC3 (0.62) AOC3
Hydrochloric Acid SCHEMBL10320413 0.78 AOC3 (0.63) AOC3
SCHEMBL11362833 0.78 AOC3 (0.61) AOC3
SCHEMBL12812550 0.76 AOC3 (0.76) 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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