SCHEMBL5694249

SCHEMBL5694249

C=CC(=O)OCCCCOc1ccccc1O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.55
ALDH1A1 P00352 3/20 0.55
CYP3A4 P08684 2/20 0.55
THRB P10828 1/20 0.54
GAA P10253 3/20 0.53
LMNA P02545 3/20 0.53
MAPT P10636 2/20 0.53
JAK2 O60674 1/20 0.53
HPGD P15428 1/20 0.46
KDM4E B2RXH2 1/20 0.43
TDP1 Q9NUW8 1/20 0.42
TP53 P04637 2/20 0.42
HIF1A Q16665 2/20 0.42
HSD17B10 Q99714 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
DRD2 P14416 1/20 0.41
DRD4 P21917 1/20 0.41
DRD3 P35462 1/20 0.41
LIG1 P18858 1/20 0.40
MEN1 O00255 1/20 0.40

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
SCHEMBL29497668 0.98 TSHR (0.58) TSHRALDH1A1CYP3A4THRBGAA
SCHEMBL3102263 0.97 THRB (0.54) TSHRALDH1A1CYP3A4THRBGAA
SCHEMBL30053278 0.92 THRB (0.64) TSHRALDH1A1CYP3A4THRBGAA
SCHEMBL4577955 0.92 THRB (0.64) TSHRALDH1A1CYP3A4THRBGAA
SCHEMBL27459990 0.89 KMT2A (0.48) TSHRALDH1A1CYP3A4THRBGAA
Acrylic Acid SCHEMBL8549385 0.88 THRB (0.63) TSHRALDH1A1CYP3A4THRBGAA
SCHEMBL29067273 0.84 ALDH1A1 (0.55) TSHRALDH1A1CYP3A4THRBGAA
SCHEMBL7623276 0.83 HTT (0.51) TSHRALDH1A1THRBMAPTTDP1
SCHEMBL1880446 0.83 ALDH1A1 (0.59) TSHRALDH1A1CYP3A4THRBGAA
SCHEMBL15910882 0.83 TDP1 (0.54) TSHRALDH1A1CYP3A4THRBLMNA

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
CN-111073435-B High-hardness anti-corrosion water-based baking coating based on liquid crystal modified acrylic resin 安徽广成新材料科技有限公司 2022-04-08 CN claimed
CN-111073435-B High-hardness anti-corrosion water-based baking coating based on liquid crystal modified acrylic resin 安徽广成新材料科技有限公司 2022-04-08 CN disclosed
EP-1342770-B1 Polymerizable liquid crystal compound, liquid crystal polymer and applications thereof FUJI PHOTO FILM CO LTD (JP) 2006-05-31 EP disclosed
EP-1342770-A1 Polymerizable liquid crystal compound, liquid crystal polymer and applications thereof FUJI PHOTO FILM CO., LTD. (JP) 2003-09-10 EP disclosed