SCHEMBL25587701

SCHEMBL25587701

Bc1c(B)c(B)c(-c2ccc(-c3c4ccccc4c(-c4ccccc4)c4ccccc34)c3ccccc23)c(B)c1B

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 2/20 0.39
▸ ESR1 P03372 5/20 0.35
▸ ESR2 Q92731 5/20 0.35
▸ MAPT P10636 3/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ LMNA P02545 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ GPR84 Q9NQS5 1/20 0.33
▸ EGFR P00533 1/20 0.32
▸ ALDH1A1 P00352 3/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ HPGD P15428 1/20 0.31
▸ THRA P10827 1/20 0.31
▸ THRB P10828 1/20 0.31
▸ PARP1 P09874 1/20 0.31
▸ ENPP1 P22413 1/20 0.30
▸ ALOX5 P09917 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
SCHEMBL21484976 0.86 ALDH1A1 (0.35) ACHEMAPTKDM4EMAPK1TDP1
SCHEMBL15128905 0.82 ACHE (0.45) ACHEESR1ESR2MAPTKDM4E
SCHEMBL29511656 0.82 ACHE (0.45) ACHEESR1ESR2MAPTKDM4E
SCHEMBL11978246 0.81 GPR84 (0.37) ACHEMAPTKDM4EMAPK1TDP1
SCHEMBL12655573 0.80 ACHE (0.46) ACHEESR1ESR2MAPTKDM4E
SCHEMBL19945794 0.78 ESR1 (0.37) ESR1ESR2MAPTKDM4EGPR84
SCHEMBL25638122 0.78 ACHE (0.38) ACHEESR1ESR2MAPTKDM4E
SCHEMBL25566404 0.77 CA12 (0.39) MAPTKDM4EMAPK1TDP1L3MBTL1
SCHEMBL18567958 0.77 ALDH1A1 (0.32) MAPK1TDP1LMNAALDH1A1HSD17B10
SCHEMBL12560724 0.77 MAPK1 (0.44) ACHEESR1ESR2MAPTKDM4E

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
US-20230180604-A1 ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING AN ELECTRON BUFFER LAYER AND AN ELECTRON TRANSPORT LAYER DUPONT SPECIALTY MATERIALS KOREA LTD (KR) 2023-06-08 — — US disclosed
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