SCHEMBL23027101

SCHEMBL23027101

Clc1nc(-c2cccc3c2oc2ccccc23)c2c(ccc3ccccc32)n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.39
PRKDC P78527 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
PIK3CD O00329 1/20 0.37
PIK3CB P42338 1/20 0.37
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
HSD17B10 Q99714 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
AHR P35869 1/20 0.35
ESR1 P03372 1/20 0.34
ESR2 Q92731 1/20 0.34
PIM1 P11309 1/20 0.34
CSNK2A2 P19784 1/20 0.34
CSNK2B P67870 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
SCHEMBL23112270 0.87 TDP1 (0.41) TDP1L3MBTL1KDM4EALDH1A1GAA
SCHEMBL14233141 0.83 KDM4E (0.46) ALOX5PRKDCPIK3CDPIK3CBKDM4E
SCHEMBL18132488 0.82 MEN1 (0.42) KDM4EALDH1A1MAPTHPGDMEN1
SCHEMBL18553591 0.81 ALOX5 (0.40) ALOX5PRKDCTDP1L3MBTL1PIK3CD
SCHEMBL22894076 0.81 ALDH1A1 (0.42) L3MBTL1KDM4EALDH1A1MAPTHPGD
SCHEMBL17297612 0.81 ALOX5 (0.42) ALOX5PRKDCPIK3CDPIK3CBKDM4E
SCHEMBL23046783 0.80 ALOX5 (0.42) ALOX5PRKDCTDP1L3MBTL1PIK3CD
SCHEMBL22697721 0.79 KDM4E (0.40) ALOX5PRKDCTDP1L3MBTL1PIK3CD
SCHEMBL17297421 0.78 PIM1 (0.46) ALOX5PRKDCL3MBTL1PIK3CDPIK3CB
SCHEMBL18688236 0.78 AHR (0.40) TDP1L3MBTL1KDM4EALDH1A1GAA

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-2021034017-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME 주식회사 엘지화학 2021-02-25 WO disclosed