SCHEMBL21926322

SCHEMBL21926322

c1ccc(C2NC(c3ccc4c(c3)sc3cccc(-c5cccc6c5oc5ccccc56)c34)=NC(c3cccc4c3sc3ccccc34)N2)cc1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ BRDT Q58F21 1/20 0.32
▸ ALOX5 P09917 1/20 0.31

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
SCHEMBL21926913 0.92 ALOX5 (0.35) ALOX5
SCHEMBL21926090 0.91 ALOX5 (0.32) ALOX5
SCHEMBL24384117 0.89 ALOX5 (0.36) ALOX5
SCHEMBL22924494 0.89 ALOX5 (0.31) ALOX5
SCHEMBL22924465 0.88 ALOX5 (0.33) BRDTALOX5
SCHEMBL21928783 0.88 ALOX5 (0.36) ALOX5
SCHEMBL22924263 0.87 ALOX5 (0.35) ALOX5
SCHEMBL22924300 0.85 ALOX5 (0.37) ALOX5
SCHEMBL24384082 0.84 ALOX5 (0.32) BRDTALOX5
SCHEMBL24383908 0.84 ALOX5 (0.32) ALOX5

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-2020085740-A1 NOVEL HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DIODE USING SAME 주식회사 엘지화학 2020-04-30 — — WO disclosed
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