SCHEMBL19496751

SCHEMBL19496751

CNCc1cccc(-c2cnc(N3CCN(c4ncc(/C=C/C(=O)O)cc4C)CC3)nc2)c1

nearest known ligand 0.73

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ AOC3 Q16853 20/20 0.73

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
SCHEMBL11421912 0.89 AOC3 (0.75) AOC3
SCHEMBL19496690 0.88 AOC3 (0.56) AOC3
SCHEMBL10317135 0.84 AOC3 (1.00) AOC3
SCHEMBL10317139 0.84 AOC3 (1.00) AOC3
Hydrochloric Acid SCHEMBL10319602 0.84 AOC3 (0.98) AOC3
Hydrochloric Acid SCHEMBL10319604 0.84 AOC3 (0.98) AOC3
SCHEMBL11419084 0.84 AOC3 (0.63) AOC3
SCHEMBL11358641 0.82 AOC3 (0.85) AOC3
SCHEMBL10318034 0.80 AOC3 (0.76) AOC3
SCHEMBL10318046 0.80 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
EP-2479165-B1 GLYCINE COMPOUND ASTELLAS PHARMA INC (JP) 2017-10-25 — — EP disclosed
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