SCHEMBL25501438

SCHEMBL25501438

C=CC(=O)OCCOCCOc1ccc(C(=O)OCCO)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.57
ALDH1A1 P00352 7/20 0.50
TSHR P16473 3/20 0.50
TP53 P04637 2/20 0.50
HIF1A Q16665 2/20 0.50
HSD17B10 Q99714 1/20 0.50
L3MBTL1 Q9Y468 3/20 0.44
MAPT P10636 3/20 0.44
LMNA P02545 3/20 0.44
GAA P10253 1/20 0.41
RAB9A P51151 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
PKM P14618 1/20 0.40
RARB P10826 1/20 0.39
SCN1A P35498 1/20 0.39
SCN2A Q99250 1/20 0.39
SCN3A Q9NY46 1/20 0.39
MEN1 O00255 1/20 0.39
USP2 O75604 1/20 0.39
CYP3A4 P08684 1/20 0.39

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
SCHEMBL17036989 0.95 THRB (0.63) THRBALDH1A1TSHRTP53HIF1A
SCHEMBL17036978 0.91 THRB (0.58) THRBALDH1A1TSHRTP53HIF1A
SCHEMBL17036983 0.89 THRB (0.56) THRBALDH1A1TSHRTP53HIF1A
SCHEMBL22891541 0.86 THRB (0.60) THRBALDH1A1TSHRTP53HIF1A
SCHEMBL14346641 0.86 THRB (0.53) THRBALDH1A1TSHRTP53HIF1A
SCHEMBL14346660 0.86 THRB (0.53) THRBALDH1A1TSHRTP53HIF1A
SCHEMBL14346631 0.86 THRB (0.53) THRBALDH1A1TSHRTP53HIF1A
SCHEMBL12918664 0.85 MAPT (0.65) THRBALDH1A1TSHRTP53HIF1A
SCHEMBL22369984 0.85 MAPT (0.65) THRBALDH1A1TSHRTP53HIF1A
SCHEMBL26238743 0.85 THRB (0.58) THRBALDH1A1TSHRTP53HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230159827-A1 LIQUID CRYSTAL COMPOSITION, FLUORINE-CONTAINING POLYMER, OPTICALLY ANISOTROPIC LAYER, LAMINATE, AND IMAGE DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2023-05-25 US disclosed
US-20230159827-A1 LIQUID CRYSTAL COMPOSITION, FLUORINE-CONTAINING POLYMER, OPTICALLY ANISOTROPIC LAYER, LAMINATE, AND IMAGE DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2023-05-25 US disclosed