SCHEMBL28645812

SCHEMBL28645812

CCOCCOC(C(=O)O)C(OCCOCCOC(C(=O)O)C(O)C(=O)O)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.38
TSHR P16473 2/20 0.38
THRB P10828 1/20 0.34
PGD P52209 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
SELP P16109 1/20 0.30

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
SCHEMBL4808939 0.84 EPHX2 (0.40) ALDH1A1TSHRTHRBSMN1; SMN2MEN1
SCHEMBL2329737 0.81 ALDH1A1 (0.43) ALDH1A1TSHRTHRBSMN1; SMN2MEN1
Di(Hydroxyethyl)Ether SCHEMBL3731848 0.79 ALDH1A1 (0.40) ALDH1A1TSHRTHRBPGDMEN1
SCHEMBL2963336 0.78 TSHR (0.41) TSHRTHRBPGD
Di(Hydroxyethyl)Ether SCHEMBL3730840 0.77 TSHR (0.39) ALDH1A1TSHRTHRBPGDMEN1
Tetraethylene Glycol SCHEMBL3729115 0.77 TSHR (0.48) ALDH1A1TSHRTHRBSMN1; SMN2MEN1
Triethylene Glycol SCHEMBL3733987 0.77 TSHR (0.48) ALDH1A1TSHRTHRBSMN1; SMN2MEN1
Cadaverine Tartrate SCHEMBL2958605 0.76 ALDH1A1 (0.56) ALDH1A1TSHRTHRBMEN1KMT2A
Cadaverine Tartrate SCHEMBL28673461 0.76 ALDH1A1 (0.56) ALDH1A1TSHRTHRBMEN1KMT2A
SCHEMBL2979038 0.76 ATM (0.41) ALDH1A1TSHRPGD

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-119869460-A Sorbent compositions, systems, and methods 通用电气技术有限公司 2025-04-25 CN claimed
CN-120202061-A Sorbent compositions, systems, and methods 通用电气技术有限公司 2025-06-24 CN disclosed
CN-119869460-A Sorbent compositions, systems, and methods 通用电气技术有限公司 2025-04-25 CN disclosed
CN-117500520-A Immunogenic compositions comprising antigen and an adjuvant comprising Al-MOF 圣康丁昂伊夫利纳凡尔赛大学 2024-02-02 CN disclosed
CN-116829611-A Reduction of monomeric isocyanates by porous materials 巴斯夫欧洲公司 2023-09-29 CN disclosed
CN-116113492-A Polyester molded article comprising a metal-organic framework with low degassing of volatile organic compounds 巴斯夫欧洲公司 2023-05-12 CN disclosed
CN-113614093-A Metal organic framework material comprising diimine scaffolds and method for producing same 埃克森美孚研究工程公司 2021-11-05 CN disclosed