SCHEMBL2865816

SCHEMBL2865816

c1ccc(-c2c3c(c(-c4ccccc4)c4ccccc24)-c2ccc(-c4ccccc4)c4c(-c5ccccc5)ccc-3c24)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.41
ENPP1 P22413 1/20 0.39
GPR84 Q9NQS5 1/20 0.38
ACHE P22303 2/20 0.38
ESR1 P03372 1/20 0.38
ESR2 Q92731 1/20 0.38
MAPT P10636 3/20 0.37
MAPK1 P28482 3/20 0.37
KDM4E B2RXH2 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
HTT P42858 2/20 0.37
LMNA P02545 1/20 0.37
BACE1 P56817 1/20 0.36
ALOX5 P09917 1/20 0.35
ALDH1A1 P00352 5/20 0.35
HPGD P15428 3/20 0.35
MEN1 O00255 1/20 0.35
MPI P34949 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL2201457 0.89 MAPK1 (0.41) PARP1ENPP1GPR84ACHEESR1
SCHEMBL29971849 0.86 MAPT (0.40) PARP1ENPP1GPR84ACHEESR1
SCHEMBL8365529 0.86 MAPT (0.40) PARP1ENPP1GPR84ACHEESR1
SCHEMBL4076119 0.85 ENPP1 (0.42) PARP1ENPP1GPR84ACHEESR1
SCHEMBL19003768 0.84 ATM (0.42) ALDH1A1MEN1KMT2A
SCHEMBL19003781 0.84 KIF11 (0.53) ENPP1ESR1MAPTTDP1BACE1
SCHEMBL3682900 0.84 MAPK1 (0.41) PARP1ENPP1ACHEESR1ESR2
SCHEMBL13932351 0.84 ACHE (0.45) ENPP1GPR84ACHEKDM4EL3MBTL1
SCHEMBL13350399 0.84 MAPT (0.33) PARP1ENPP1GPR84ACHEESR1
SCHEMBL13318342 0.82 MAPK1 (0.40) PARP1ENPP1ACHEESR1ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8790792-B2 Organic electroluminescent device SEIKO EPSON CORPORATION (JP) 2014-07-29 US disclosed
US-7727642-B2 Light emitting polymer dopant including the units: 3,4,7,12-tetraphenylbenzo[k]fluoranthene, triphenylamine, 9,9-dialkyl- or diaryl-substituted fluorene and optionally diphenylmethane and alkyl- or arylbenzene; high efficiency of light emission and long life span SEIKO EPSON CORPORATION (JP) 2010-06-01 US disclosed
US-20080241592-A1 ORGANIC ELECTROLUMINESCENT DEVICE SEIKO EPSON CORPORATION (JP) 2008-10-02 US disclosed
US-20070244295-A1 Light emitting polymer dopant including the units: 3,4,7,12-tetraphenylbenzo[k]fluoranthene, triphenylamine, 9,9-dialkyl- or diaryl-substituted fluorene and optionally diphenylmethane and alkyl- or arylbenzene; high efficiency of light emission and long life span SEIKO EPSON CORPORATION (JP) 2007-10-18 US disclosed