SCHEMBL9261990

SCHEMBL9261990

CCCOC(CC)OCCCCc1ccc(OC(C)=O)cc1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
THRB P10828 4/20 0.47
THRA P10827 2/20 0.45
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
KMT2A Q03164 2/20 0.40
LMNA P02545 2/20 0.40
MEN1 O00255 1/20 0.39
CACNA1B Q00975 1/20 0.39
APBA1 Q02410 1/20 0.39
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
PKM P14618 1/20 0.39
FFAR1 O14842 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
SCHEMBL9259776 0.91 THRB (0.43) THRBTHRANPC1RAB9ASMN1; SMN2
SCHEMBL9259773 0.85 HSD17B10 (0.49) THRBTHRAL3MBTL1KMT2AMEN1
SCHEMBL9252735 0.82 RARB (0.57) NPC1RAB9ASMN1; SMN2KMT2AMEN1
SCHEMBL9259438 0.82 THRB (0.47) THRBTHRANPC1RAB9ASMN1; SMN2
SCHEMBL9261995 0.81 THRB (0.44) THRBTHRASMN1; SMN2L3MBTL1KMT2A
SCHEMBL9262000 0.81 THRB (0.51) THRBTHRANPC1RAB9ASMN1; SMN2
SCHEMBL9260714 0.80 ESR1 (0.54) LMNA
SCHEMBL1810213 0.80 THRB (0.69) THRBTHRALMNA
SCHEMBL9259443 0.79 THRB (0.60) THRBTHRASMN1; SMN2L3MBTL1KMT2A
SCHEMBL8086401 0.78 THRB (0.68) THRBTHRASMN1; SMN2KMT2ALMNA

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