SCHEMBL25501848

SCHEMBL25501848

C=C(C)C(=O)OCCCCCC(=O)OCCCCCC(=O)OCCCCCC(=O)OCCCCCC(=O)OCCOC(=O)C(C)CC

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.54
DGKA P23743 1/20 0.46
THRB P10828 1/20 0.44
POLB P06746 1/20 0.43
APEX1 P27695 1/20 0.43
HTT P42858 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
PRSS1 P07477 1/20 0.39
PRSS2 P07478 1/20 0.39
PRSS3 P35030 1/20 0.39
MAPT P10636 1/20 0.38
DNM1 Q05193 1/20 0.37
HTR2C P28335 1/20 0.36
NAAA Q02083 1/20 0.36
RAD52 P43351 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
PLA2G2A P14555 2/20 0.34
LMNA P02545 1/20 0.34

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
SCHEMBL12392172 0.90 THRB (0.50) TSHRDGKATHRBPOLBAPEX1
SCHEMBL12793081 0.88 TSHR (0.62) TSHRTHRBPOLBAPEX1HTT
SCHEMBL12938676 0.87 TSHR (0.65) TSHRDGKATHRBPOLBAPEX1
SCHEMBL2622701 0.85 TSHR (0.58) TSHRTHRBPOLBAPEX1HTT
SCHEMBL11226568 0.85 TSHR (0.67) TSHRDGKATHRBPOLBAPEX1
SCHEMBL11219249 0.85 TSHR (0.67) TSHRDGKATHRBPOLBAPEX1
SCHEMBL11230384 0.85 TSHR (0.67) TSHRDGKATHRBPOLBAPEX1
SCHEMBL4544635 0.85 THRB (0.58) TSHRTHRBPOLBAPEX1HTT
SCHEMBL14907540 0.85 TSHR (0.67) TSHRDGKATHRBPOLBAPEX1
SCHEMBL14213183 0.84 TSHR (0.77) TSHRDGKATHRBPOLBAPEX1

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
US-20230265346-A1 LIQUID CRYSTAL COMPOSITION, OPTICALLY ANISOTROPIC LAYER, LAMINATE, AND IMAGE DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2023-08-24 US disclosed
US-20230212460-A1 COMPOSITION FOR FORMING PHOTO-ALIGNMENT FILM, PHOTO-ALIGNMENT FILM, AND OPTICAL LAMINATE FUJIFILM CORPORATION (JP) 2023-07-06 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