SCHEMBL9254255

SCHEMBL9254255

CCCC(C)OCCCc1ccc(OC(C)=O)cc1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
THRB P10828 3/20 0.45
THRA P10827 1/20 0.43
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
KMT2A Q03164 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
PPARG P37231 1/20 0.40
ACACB O00763 1/20 0.39
LMNA P02545 1/20 0.39
ELANE P08246 2/20 0.39
GLS O94925 1/20 0.39
ALDH1A1 P00352 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
SCHEMBL9259438 0.96 THRB (0.47) THRBTHRANPC1RAB9ASMN1; SMN2
SCHEMBL8148796 0.86 ACACB (0.46) THRBTHRANPC1RAB9ASMN1; SMN2
SCHEMBL9251073 0.85 HSD17B10 (0.50) THRBTHRAKMT2AL3MBTL1
SCHEMBL8158421 0.83 ACACB (0.44) THRBKMT2AL3MBTL1ACACBLMNA
SCHEMBL9252643 0.82 RARB (0.56) NPC1RAB9ASMN1; SMN2KMT2AALDH1A1
SCHEMBL9256282 0.81 HSD17B10 (0.49) THRBTHRAKMT2AL3MBTL1ALDH1A1
SCHEMBL9259723 0.80 ESR1 (0.51) SMN1; SMN2LMNAALDH1A1
SCHEMBL9261995 0.80 THRB (0.44) THRBTHRASMN1; SMN2KMT2AL3MBTL1
SCHEMBL1415501 0.79 THRB (0.61) THRBTHRANPC1RAB9ASMN1; SMN2
SCHEMBL9257556 0.78 SMN1; SMN2 (0.57) THRBTHRANPC1SMN1; SMN2KMT2A

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 5 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
EP-0357372-A2 Optically active ester derivatives, preparation process thereof, liquid crystal materials and a light switching element SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1990-03-07 EP disclosed