SCHEMBL2385673

SCHEMBL2385673

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

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.42
GAA P10253 1/20 0.42
SI P14410 1/20 0.42
MGAM2 Q2M2H8 1/20 0.42
THRB P10828 1/20 0.41
ALDH1A1 P00352 9/20 0.40
CYP3A4 P08684 2/20 0.40
ALOX15 P16050 2/20 0.40
HSD17B10 Q99714 2/20 0.40
CHRM1 P11229 1/20 0.40
ADORA1 P30542 1/20 0.40
TSHR P16473 6/20 0.39
TDP1 Q9NUW8 1/20 0.37
TRPA1 O75762 1/20 0.35
GLO1 Q04760 1/20 0.35
LMNA P02545 1/20 0.34
CYP2D6 P10635 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CYP1A2 P05177 1/20 0.32
POLB P06746 1/20 0.31

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
SCHEMBL28142283 0.90 GAA (0.44) MGAMGAASIMGAM2THRB
SCHEMBL20952184 0.88 MGAM (0.41) MGAMGAASIMGAM2THRB
SCHEMBL27758327 0.87 THRB (0.34) MGAMGAASIMGAM2THRB
SCHEMBL1408304 0.86 THRB (0.41) MGAMGAASIMGAM2THRB
SCHEMBL27873266 0.82 ALDH1A1 (0.44) ALDH1A1TSHRTDP1LMNAL3MBTL1
SCHEMBL10010403 0.82 ALDH1A1 (0.44) MGAMGAASIMGAM2ALDH1A1
SCHEMBL15721249 0.81 THRB (0.42) MGAMGAASIMGAM2THRB
SCHEMBL25779943 0.79 MGAM (0.42) MGAMGAASIMGAM2THRB
SCHEMBL6558912 0.79 TDP1 (0.39) THRBALDH1A1CYP3A4TSHRTDP1
SCHEMBL10011811 0.78 ALDH1A1 (0.44) MGAMGAASIMGAM2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113316609-A Solvent-free formulations and nanocomposites 皮瑟莱根特科技有限责任公司 2021-08-27 CN claimed
CN-113316609-B Solvent-free formulation and nanocomposite 皮瑟莱根特科技有限责任公司 2024-03-08 CN disclosed
CN-114341281-A Curable ink composition, cured product, and nanocomposite material 东京应化工业株式会社 2022-04-12 CN disclosed
CN-113316609-A Solvent-free formulations and nanocomposites 皮瑟莱根特科技有限责任公司 2021-08-27 CN disclosed
CN-113227463-A Synthesis, capping and dispersion of TiO2 nanocrystals 皮瑟莱根特科技有限责任公司 2021-08-06 CN disclosed
US-8506069-B2 Inkjet ink set, and image forming method FUJIFILM CORPORATION (JP) 2013-08-13 US disclosed
US-20110234689-A1 INKJET INK SET, AND IMAGE FORMING METHOD FUJIFILM CORPORATION (JP) 2011-09-29 US disclosed