SCHEMBL28253182

SCHEMBL28253182

CCCCOCCOc1ccc2cc3ccccc3cc2c1OCCOCCCC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.46
KDM4E B2RXH2 2/20 0.46
MAPK1 P28482 1/20 0.46
L3MBTL1 Q9Y468 3/20 0.46
GAA P10253 1/20 0.46
KCNH2 Q12809 3/20 0.41
MAPT P10636 2/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TLR8 Q9NR97 1/20 0.41
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
CNR1 P21554 1/20 0.40
CNR2 P34972 1/20 0.40
NCF1 P14598 4/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39

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
SCHEMBL520954 0.93 GAA (0.51) TDP1KDM4EL3MBTL1GAAKCNH2
SCHEMBL27599502 0.92 GAA (0.50) TDP1KDM4EL3MBTL1GAAKCNH2
SCHEMBL27740256 0.90 GAA (0.49) TDP1KDM4EL3MBTL1GAAKCNH2
SCHEMBL23529417 0.89 TLR8 (0.47) TDP1KDM4EL3MBTL1GAAKCNH2
SCHEMBL28253133 0.87 NCF1 (0.47) TDP1KDM4EMAPK1L3MBTL1GAA
SCHEMBL27800237 0.87 TDP1 (0.49) TDP1KDM4EL3MBTL1GAAKCNH2
SCHEMBL27924031 0.87 TLR8 (0.48) TDP1L3MBTL1GAAKCNH2MAPT
SCHEMBL28235946 0.87 TLR8 (0.48) TDP1L3MBTL1GAAKCNH2MAPT
SCHEMBL27803631 0.87 TDP1 (0.46) TDP1KDM4EL3MBTL1GAAKCNH2
SCHEMBL521956 0.86 TLR8 (0.44) TDP1KDM4EL3MBTL1GAAKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110225933-A Aqueous polyurethane resin combination 株式会社艾迪科 2019-09-10 CN disclosed
CN-110114376-A Curable composition, method for producing cured product, cured product thereof, and adhesive using same 株式会社ADEKA 2019-08-09 CN disclosed
CN-109312055-A Curable composition, method for producing cured product, and cured product thereof 株式会社ADEKA 2019-02-05 CN disclosed
CN-108884298-A Curable composition, method for producing cured product, and cured product thereof 株式会社ADEKA 2018-11-23 CN disclosed
CN-108884299-A Curable composition, method for producing cured product, and cured product thereof 株式会社ADEKA 2018-11-23 CN disclosed
CN-108884297-A Solidification compound, the manufacturing method of solidfied material and its solidfied material 株式会社ADEKA 2018-11-23 CN disclosed