SCHEMBL25847330

SCHEMBL25847330

c1ccc2c(c1)ccc1ccc(-c3nc(-c4cccc5c4oc4c6ccccc6ccc54)nc(-c4cccc5oc6ccccc6c45)n3)cc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.39
TDP1 Q9NUW8 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
PRKDC P78527 2/20 0.37
ARSA P15289 1/20 0.36
CDC25A P30304 1/20 0.36
CDC25C P30307 1/20 0.36
CYP1A1 P04798 10/20 0.36
CYP1B1 Q16678 10/20 0.36
ABCB1 P08183 2/20 0.35
ABCC1 P33527 2/20 0.35
ABCG2 Q9UNQ0 2/20 0.35
CYP1A2 P05177 9/20 0.34
CYP3A4 P08684 2/20 0.34
TSHR P16473 2/20 0.34
CYP2C19 P33261 2/20 0.34
KDM4E B2RXH2 1/20 0.34
PDE5A O76074 1/20 0.34
ALDH1A1 P00352 1/20 0.34
TP53 P04637 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
SCHEMBL24930759 0.93 ALOX5 (0.44) ALOX5TDP1L3MBTL1PRKDCTSHR
SCHEMBL25847073 0.91 ALOX5 (0.40) ALOX5TDP1L3MBTL1PRKDCCYP1A1
SCHEMBL24930664 0.90 TDP1 (0.42) ALOX5TDP1L3MBTL1CYP1B1CYP1A2
SCHEMBL23820650 0.90 L3MBTL1 (0.41) ALOX5TDP1L3MBTL1CYP1B1CYP1A2
SCHEMBL23822735 0.90 L3MBTL1 (0.41) ALOX5TDP1L3MBTL1CYP1B1CYP1A2
SCHEMBL25847071 0.90 CYP1A1 (0.39) ALOX5TDP1L3MBTL1PRKDCARSA
SCHEMBL23820662 0.89 ALOX5 (0.45) ALOX5TDP1L3MBTL1PRKDCCYP1A1
SCHEMBL23820658 0.89 ALOX5 (0.45) ALOX5TDP1L3MBTL1PRKDCTSHR
SCHEMBL25132297 0.89 PLA2G2A (0.39) ALOX5TDP1L3MBTL1PRKDCARSA
SCHEMBL26597993 0.89 PLA2G2A (0.39) ALOX5TDP1L3MBTL1PRKDCARSA

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-2023132694-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-07-13 WO disclosed