SCHEMBL21926091

SCHEMBL21926091

c1ccc(C2NC(c3ccc4oc5cc(-c6cccc7c6sc6ccccc67)ccc5c4c3)=NC(c3cccc4c3oc3ccccc34)N2)cc1

nearest known ligand 0.37

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PRKDC P78527 2/20 0.37
▸ ALOX5 P09917 2/20 0.35

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
SCHEMBL22924263 0.94 ALOX5 (0.35) PRKDCALOX5
SCHEMBL24383950 0.94 PRKDC (0.37) PRKDCALOX5
SCHEMBL21928783 0.91 ALOX5 (0.36) PRKDCALOX5
SCHEMBL21926078 0.91 PRKDC (0.38) PRKDCALOX5
SCHEMBL24384068 0.89 PRKDC (0.37) PRKDCALOX5
SCHEMBL21926977 0.89 PRKDC (0.41) PRKDCALOX5
SCHEMBL24383938 0.88 ALOX5 (0.35) PRKDCALOX5
SCHEMBL21926088 0.88 ALOX5 (0.35) PRKDCALOX5
SCHEMBL22924251 0.88 PRKDC (0.34) PRKDCALOX5
SCHEMBL21926976 0.88 PRKDC (0.38) PRKDCALOX5

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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