SCHEMBL29068293

SCHEMBL29068293

C=C(C)C(=O)OP(=O)(O)OCC.CC[N+](C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.36
ALDH1A1 P00352 2/20 0.32
TSHR P16473 4/20 0.32
PPARD Q03181 1/20 0.32
BTN3A1 O00481 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
SCHEMBL872244 0.91 THRB (0.41) THRBALDH1A1TSHRPPARDBTN3A1
SCHEMBL6028707 0.82 THRB (0.35) THRBALDH1A1TSHR
SCHEMBL819118 0.80 CHRM5 (0.40) TSHRBTN3A1
Phosphoric Acid SCHEMBL28996617 0.77 THRB (0.47) THRBALDH1A1TSHR
SCHEMBL2638491 0.77 TSHR (0.42) THRBALDH1A1TSHRBTN3A1
SCHEMBL2567133 0.77 ALDH1A1 (0.38) THRBALDH1A1TSHRBTN3A1
SCHEMBL9276375 0.75 ALDH1A1 (0.48) THRBALDH1A1TSHRBTN3A1
Diethyl Hydrogen Phosphate SCHEMBL973991 0.75 THRB (0.48) THRBALDH1A1TSHRPPARD
SCHEMBL3322636 0.75 ALDH1A1 (0.37) THRBALDH1A1TSHRBTN3A1
SCHEMBL6293184 0.75 POLB (0.33) THRBTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116568730-A Multiphase suspension of water-soluble polymers 爱森集团 2023-08-08 CN claimed
CN-117980560-A Method for producing paper and board 爱森集团 2024-05-03 CN disclosed
CN-117396647-A Method for producing paper and board 爱森集团 2024-01-12 CN disclosed
CN-117203392-A Method for producing paper and board 爱森集团 2023-12-08 CN disclosed
CN-116670357-A Method for producing paper or board 爱森集团 2023-08-29 CN disclosed
CN-116568730-A Multiphase suspension of water-soluble polymers 爱森集团 2023-08-08 CN disclosed