SCHEMBL24357376

SCHEMBL24357376

c1ccc(C2=NC(c3ccc(-c4ccccc4)cc3)NC(c3cccc(-c4cccc5oc6c(-c7ccc8ccccc8c7)cccc6c45)c3)N2)cc1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PRKDC P78527 1/20 0.33
▸ ALOX5 P09917 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.31
▸ MAPT P10636 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
SCHEMBL24890196 0.93 PRKDC (0.33) PRKDCALOX5ALDH1A1MAPT
SCHEMBL24356829 0.91 ALDH1A1 (0.33) PRKDCALOX5ALDH1A1MAPT
SCHEMBL24949935 0.91 ALDH1A1 (0.33) PRKDCALOX5ALDH1A1MAPT
SCHEMBL24907595 0.90 PRKDC (0.33) PRKDCALOX5ALDH1A1MAPT
SCHEMBL24356563 0.89 ALOX5 (0.34) PRKDCALOX5ALDH1A1
SCHEMBL24886662 0.89 PRKDC (0.33) PRKDCALOX5ALDH1A1MAPT
SCHEMBL24886427 0.89 PRKDC (0.33) PRKDCALOX5
SCHEMBL24374114 0.88 PRKDC (0.31) PRKDCALOX5
SCHEMBL24886689 0.88 CDC14B (0.32) ALOX5
SCHEMBL24890270 0.88 ALDH1A1 (0.31) ALDH1A1MAPT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022086297-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2022-04-28 — — WO disclosed
WO-2022086296-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2022-04-28 — — WO disclosed
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