SCHEMBL4606935

SCHEMBL4606935

CCCC(=O)OC(=O)CCCc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 4/20 0.56
HDAC3 O15379 3/20 0.56
HDAC2 Q92769 3/20 0.56
HDAC8 Q9BY41 3/20 0.56
HDAC6 Q9UBN7 3/20 0.56
HDAC5 Q9UQL6 3/20 0.56
HDAC4 P56524 2/20 0.56
HDAC7 Q8WUI4 2/20 0.56
HDAC10 Q969S8 2/20 0.56
HDAC11 Q96DB2 2/20 0.56
HDAC9 Q9UKV0 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
MAPK1 P28482 1/20 0.56
ADRA1A P35348 1/20 0.56
SLC6A3 Q01959 1/20 0.56
ALOX5 P09917 1/20 0.54
ALDH1A1 P00352 2/20 0.52
TDP1 Q9NUW8 4/20 0.51
NPC1 O15118 1/20 0.51
CASP3 P42574 1/20 0.51

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
SCHEMBL27825851 0.98 HDAC1 (0.55) HDAC1HDAC3HDAC2HDAC8HDAC6
SCHEMBL27542155 0.93 MAPT (0.59) HDAC1HDAC3HDAC2HDAC8HDAC6
SCHEMBL544942 0.91 HDAC1 (0.58) HDAC1HDAC3HDAC2HDAC8HDAC6
SCHEMBL2222140 0.91 HDAC1 (0.67) HDAC1HDAC3HDAC2HDAC8HDAC6
SCHEMBL23069543 0.89 TDP1 (0.61) HDAC3HDAC2HDAC8HDAC6ALDH1A1
SCHEMBL17223648 0.89 HDAC1 (0.64) HDAC1HDAC3HDAC2HDAC8HDAC6
SCHEMBL406382 0.88 ALOX5 (0.59) HDAC1HDAC3HDAC2HDAC8HDAC6
SCHEMBL8790951 0.88 MAPT (0.56) HDAC1HDAC3HDAC2HDAC8HDAC6
SCHEMBL7431738 0.87 TDP1 (0.63) HDAC1HDAC3HDAC2HDAC8HDAC6
SCHEMBL13498527 0.87 MAPT (0.63) HDAC1HDAC3HDAC2HDAC8HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111433964-B Electrolyte solution, electrochemical device, lithium ion secondary battery, and assembly 大金工业株式会社 2023-02-17 CN disclosed
WO-2016009630-A1 METHOD FOR PRODUCING ALGA FAT OR OIL AND ALGA FAT OR OIL PRODUCTION PROMOTER 国立研究開発法人科学技術振興機構 2016-01-21 WO disclosed
EP-1390491-B1 METHOD FOR TREATING NEURODEGENERATIVE, PSYCHIATRIC AND OTHER DISORDERS WITH DEACETYLASE INHIBITORS UNIV CALIFORNIA (US) 2008-07-16 EP disclosed
EP-0672648-B1 Threo (2R,3S)-3-amino-2-hydroxypentanoic acid and threo (2R,3S)-3-(p-methoxy-benzyloxycarbonyl/FMOC) amino-2-hydroxy-pentanoic acid ZAIDAN HOJIN BISEIBUTSU (JP) 1998-09-23 EP disclosed
EP-0672648-A1 Threo-3-amino-2-hydroxypentanoic acid and threo (2R,3S), (2S,3R)-3-(p-methoxy-benzyloxycarbonyl) amino-2-hydroxy-pentanoic acid ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1995-09-20 EP disclosed
US-5359138-A Endopeptidase inhibitors for treatment of amnesia and autoimmune diseases ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1994-10-25 US disclosed
US-5162500-A POSTSTATIN AND RELATED COMPOUNDS OR SALTS THEREOF ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1992-11-10 US disclosed
EP-0423358-A1 POSTOSTATIN AND RELATED COMPOUND THEREOF, OR THEIR SALTS ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1991-04-24 EP disclosed
US-4006009-A 1-Thiadiazolyl-6-acyloxytetrahydropyrimidinone herbicides VELSICOL CHEMICAL CORPORATION (US) 1977-02-01 US disclosed
US-4004912-A 1-Thiadiazolyl-6-acyloxytetrahydropyrimidinone herbicides VELSICOL CHEMICAL CORPORATION (US) 1977-01-25 US disclosed