SCHEMBL9259776

SCHEMBL9259776

CCCOC(CC)OCCc1ccc(OC(C)=O)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 3/20 0.43
LMNA P02545 3/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MAPT P10636 2/20 0.41
POLB P06746 1/20 0.41
PKM P14618 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
ALDH1A1 P00352 1/20 0.40
PTGS2 P35354 1/20 0.39
THRA P10827 1/20 0.39
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
CACNA1B Q00975 1/20 0.39
APBA1 Q02410 1/20 0.39
ACACB O00763 2/20 0.39
PLA2G1B P04054 1/20 0.38
ATG4B Q9Y4P1 1/20 0.38
KDM4E B2RXH2 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
SCHEMBL9261990 0.91 THRB (0.47) THRBLMNAL3MBTL1MAPTPOLB
SCHEMBL9260096 0.82 KMT2A (0.44) THRBLMNAL3MBTL1MAPTPOLB
SCHEMBL8148796 0.80 ACACB (0.46) THRBLMNAL3MBTL1MAPTPOLB
SCHEMBL9259782 0.80 THRB (0.40) THRBLMNAL3MBTL1SMN1; SMN2NPC1
SCHEMBL9260224 0.79 ESR1 (0.46) LMNAL3MBTL1MAPTPKMSMN1; SMN2
SCHEMBL3899589 0.78 THRB (0.66) THRBLMNAL3MBTL1MAPTPOLB
SCHEMBL8158421 0.77 ACACB (0.44) THRBLMNAL3MBTL1KMT2AMEN1
SCHEMBL9486932 0.77 POLB (0.44) THRBLMNAL3MBTL1MAPTPOLB
SCHEMBL9259786 0.77 L3MBTL1 (0.47) THRBLMNAL3MBTL1MAPTPOLB
SCHEMBL11785681 0.76 THRB (0.64) THRBLMNAL3MBTL1MAPTPOLB

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-5385693-A Having rapid response and low phase transition temperature SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1995-01-31 US disclosed
EP-0357372-B1 Optically active ester derivatives, preparation process thereof, liquid crystal materials and a light switching element SUMITOMO CHEMICAL CO (JP) 1994-11-17 EP disclosed
US-5264151-A Optically active ester derivatives, preparation process thereof, liquid crystal materials and a light switching element SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-11-23 US disclosed
US-5124070-A High speed response SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-06-23 US disclosed