SCHEMBL21926047

SCHEMBL21926047

c1ccc(C2NC(c3cccc4c3sc3ccc(-c5cccc6c5sc5ccccc56)cc34)=NC(c3cccc4oc5ccccc5c34)N2)cc1

nearest known ligand 0.37

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 1/20 0.37
▸ PRKDC P78527 1/20 0.34

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
SCHEMBL21926039 0.95 ALOX5 (0.37) ALOX5PRKDC
SCHEMBL21926088 0.92 ALOX5 (0.35) ALOX5PRKDC
SCHEMBL24383908 0.90 ALOX5 (0.32) ALOX5PRKDC
SCHEMBL24384068 0.90 PRKDC (0.37) ALOX5PRKDC
SCHEMBL24383929 0.89 ALOX5 (0.37) ALOX5PRKDC
SCHEMBL21926050 0.88 ALOX5 (0.37) ALOX5PRKDC
SCHEMBL22924367 0.88 ALOX5 (0.37) ALOX5PRKDC
SCHEMBL22924193 0.86 PRKDC (0.35) PRKDC
SCHEMBL22924327 0.86 ALOX5 (0.36) ALOX5PRKDC
SCHEMBL22924182 0.85 ALOX5 (0.42) ALOX5PRKDC

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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