SCHEMBL21926950

SCHEMBL21926950

c1ccc(C2=NC(c3cccc4c3oc3cc(-c5cccc6oc7ccccc7c56)ccc34)NC(c3cccc4oc5ccccc5c34)N2)cc1

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 2/20 0.36
▸ PRKDC P78527 1/20 0.34
▸ GGPS1 O95749 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
SCHEMBL22924295 0.94 ALOX5 (0.34) ALOX5
SCHEMBL21926873 0.89 ALOX5 (0.36) ALOX5PRKDC
SCHEMBL22924503 0.89 PLA2G2A (0.33) ALOX5
SCHEMBL24231106 0.89 ALOX5 (0.34) ALOX5PRKDC
SCHEMBL26400164 0.88 ALOX5 (0.32) ALOX5PRKDC
SCHEMBL24888145 0.88 ALOX5 (0.39) ALOX5PRKDCGGPS1
SCHEMBL22924297 0.87 ALOX5 (0.34) ALOX5PRKDC
SCHEMBL22924413 0.86 ALOX5 (0.34) ALOX5PRKDCGGPS1
SCHEMBL24384118 0.86 ALOX5 (0.35) ALOX5PRKDCGGPS1
SCHEMBL21926132 0.86 ALOX5 (0.38) ALOX5PRKDCGGPS1

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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