SCHEMBL25909421

SCHEMBL25909421

c1ccc(N(c2ccc(-c3cc4ccccc4c4ccccc34)cc2)c2ccc(-c3ccc4ccc5ccccc5c4c3)c(-c3cccc4c3sc3ccccc34)c2)cc1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.41
PARP14 Q460N5 1/20 0.33
PRKDC P78527 2/20 0.32
S1PR4 O95977 1/20 0.31
S1PR5 Q9H228 1/20 0.31
MCL1 Q07820 1/20 0.30
ACMSD Q8TDX5 1/20 0.30
F9 P00740 1/20 0.30

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
SCHEMBL22159602 0.90 ALOX5 (0.44) ALOX5PARP14PRKDCS1PR4S1PR5
SCHEMBL22159593 0.90 ALOX5 (0.45) ALOX5PARP14PRKDCS1PR4S1PR5
SCHEMBL23313577 0.89 ALOX5 (0.40) ALOX5PARP14PRKDCF9
SCHEMBL23313453 0.89 ALOX5 (0.40) ALOX5PARP14PRKDCF9
SCHEMBL25628930 0.89 ALOX5 (0.41) ALOX5PARP14PRKDCF9
SCHEMBL25731013 0.88 ALOX5 (0.47) ALOX5PARP14PRKDCF9
SCHEMBL23313527 0.87 ALOX5 (0.40) ALOX5PARP14PRKDCF9
SCHEMBL23471933 0.86 ALOX5 (0.50) ALOX5PARP14PRKDCF9
SCHEMBL23821930 0.86 ALOX5 (0.50) ALOX5PARP14PRKDCF9
SCHEMBL26056739 0.86 ALOX5 (0.47) ALOX5PARP14PRKDCS1PR4S1PR5

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-2023146343-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME 주식회사 엘지화학 2023-08-03 WO disclosed