SCHEMBL8085231

SCHEMBL8085231

O=C(O)c1ccc(-c2ccc(OCCCOC3(C(=O)O)C=CC(c4ccccc4)=CC3)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.44
RARB P10826 5/20 0.44
PPARD Q03181 3/20 0.40
PLA2G4B P0C869 2/20 0.40
ALDH1A1 P00352 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
PPARG P37231 2/20 0.39
PPARA Q07869 2/20 0.39
HDAC1 Q13547 3/20 0.39
HDAC2 Q92769 3/20 0.39
HDAC3 O15379 2/20 0.39
HDAC4 P56524 2/20 0.39
HDAC7 Q8WUI4 2/20 0.39
HDAC10 Q969S8 2/20 0.39
HDAC11 Q96DB2 2/20 0.39
HDAC8 Q9BY41 2/20 0.39
HDAC6 Q9UBN7 2/20 0.39
HDAC9 Q9UKV0 2/20 0.39
HDAC5 Q9UQL6 2/20 0.39
TP53 P04637 1/20 0.38

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
SCHEMBL8402337 0.98 RARB (0.46) PKMRARBPLA2G4BALDH1A1L3MBTL1
SCHEMBL8404120 0.97 RARB (0.48) PKMRARBPLA2G4BHDAC1HDAC2
SCHEMBL8400401 0.97 RARB (0.48) PKMRARBPLA2G4BHDAC1HDAC2
SCHEMBL8400336 0.97 RARB (0.48) PKMRARBPLA2G4BHDAC1HDAC2
SCHEMBL8082004 0.97 RARB (0.48) PKMRARBPLA2G4BHDAC1HDAC2
SCHEMBL8403743 0.97 RARB (0.48) PKMRARBPLA2G4BHDAC1HDAC2
SCHEMBL8404123 0.97 RARB (0.48) PKMRARBPLA2G4BHDAC1HDAC2
SCHEMBL8402402 0.97 RARB (0.48) PKMRARBPLA2G4BHDAC1HDAC2
SCHEMBL8400566 0.95 PKM (0.48) PKMRARBPPARDHDAC1HDAC2
SCHEMBL8085070 0.90 RARB (0.45) PKMRARBPPARDPLA2G4BALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0758013-B1 Liquid crystalline optical film, compensating film for liquid crystal display and liquid crystal display NIPPON OIL CO LTD (JP) 2000-10-11 EP disclosed
US-5855971-A Liquid crystalline optical film, compensating film for liquid crystal display comprising the liquid crystalline optical film, and liquid crystal display having the compensating film NIPPON OIL COMPANY, LIMITED (JP) 1999-01-05 US disclosed
EP-0758013-A1 Liquid crystalline optical film, compensating film for liquid crystal display and liquid crystal display NIPPON OIL COMPANY, LIMITED (JP) 1997-02-12 EP disclosed