SCHEMBL26102789

SCHEMBL26102789

C=CC(=O)OC(=C)C(=O)OCC

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.44
ALDH1A1 P00352 10/20 0.42
TSHR P16473 9/20 0.42
HPGD P15428 1/20 0.42
GLO1 Q04760 1/20 0.39
SOAT1 P35610 1/20 0.38
TP53 P04637 3/20 0.38
HIF1A Q16665 3/20 0.38
HSD17B10 Q99714 2/20 0.38
CYP3A4 P08684 2/20 0.38
HCAR2 Q8TDS4 1/20 0.36
THRB P10828 1/20 0.36
MAPT P10636 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
CYP2D6 P10635 1/20 0.35
LMNA P02545 1/20 0.34
MAPK1 P28482 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
SCHEMBL27793470 0.85 TSHR (0.48) ALDH1A1TSHRHPGDTP53HIF1A
SCHEMBL27677162 0.83 TSHR (0.36) NPSR1ALDH1A1TSHRHPGDGLO1
SCHEMBL27869150 0.81 TSHR (0.53) NPSR1ALDH1A1TSHRHPGDGLO1
Acrylic Acid Ethyl Ester SCHEMBL8160218 0.80 NPSR1 (0.48) NPSR1ALDH1A1TSHRHPGDGLO1
SCHEMBL25387668 0.79 TSHR (0.48) ALDH1A1TSHRHPGDTP53HIF1A
SCHEMBL27873316 0.79 TSHR (0.63) ALDH1A1TSHRHPGDTP53HIF1A
SCHEMBL28929032 0.79 TSHR (0.45) NPSR1ALDH1A1TSHRHPGDSOAT1
SCHEMBL28050114 0.78 TSHR (0.61) ALDH1A1TSHRHPGDTP53HIF1A
Acrylic Acid Methyl Ester SCHEMBL3623327 0.77 NPSR1 (0.41) NPSR1ALDH1A1TSHRHPGDGLO1
SCHEMBL3137530 0.77 ALDH1A1 (0.50) NPSR1ALDH1A1TSHRGLO1SOAT1

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
WO-2023074967-A1 COPOLYMER FOR SEPARATOR, AND SECONDARY BATTERY COMPRISING SAME 주식회사 한솔케미칼 2023-05-04 WO disclosed
CN-108495868-B Cationic polymers having at least a bimodal molecular weight distribution 巴斯夫欧洲公司 2021-03-19 CN disclosed
CN-111093841-A Method for forming multilayer coating film 关西涂料株式会社 2020-05-01 CN disclosed
CN-101864035-A Method for preparing grafted starch by microwave DAIHONG LUO 2010-10-20 CN disclosed