SCHEMBL28654643

SCHEMBL28654643

OCC(O)C(O)C(O)C(O)C(O)=Cc1ccc(O)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE4A P27815 1/20 0.40
▸ LMNA P02545 2/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ ESR1 P03372 4/20 0.36
▸ ESR2 Q92731 3/20 0.36
▸ TDP1 Q9NUW8 1/20 0.35
▸ CISD1 Q9NZ45 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ THRB P10828 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ KDM4E B2RXH2 2/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ SLC16A3 O15427 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ SLC16A1 P53985 1/20 0.33
▸ GPR35 Q9HC97 1/20 0.33
▸ APP P05067 1/20 0.32
▸ NQO2 P16083 1/20 0.32
▸ PTGS1 P23219 1/20 0.32

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
Mannitol SCHEMBL27796662 0.86 PDE4A (0.42) PDE4ALMNAL3MBTL1ESR1TDP1
Benzene SCHEMBL28171160 0.86 PDE4A (0.42) PDE4ALMNAL3MBTL1ESR1TDP1
SCHEMBL20945396 0.86 PDE4A (0.42) PDE4ALMNAL3MBTL1ESR1TDP1
SCHEMBL448867 0.86 PDE4A (0.42) PDE4ALMNAL3MBTL1ESR1TDP1
SCHEMBL5026236 0.86 PDE4A (0.42) PDE4ALMNAL3MBTL1ESR1TDP1
SCHEMBL5069345 0.85 PDE4A (0.43) PDE4ALMNAL3MBTL1TDP1ALDH1A1
SCHEMBL21049665 0.85 PDE4A (0.39) PDE4ALMNAL3MBTL1TDP1KMT2A
SCHEMBL20506870 0.85 PDE4A (0.43) PDE4ALMNAL3MBTL1TDP1ALDH1A1
SCHEMBL1253981 0.85 PDE4A (0.39) PDE4ALMNAL3MBTL1TDP1KMT2A
SCHEMBL27885025 0.84 TP53 (0.41) PDE4ALMNAL3MBTL1TDP1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114656693-A Nucleating agent and product thereof 上海齐润新材料有限公司 2022-06-24 — — CN disclosed
CN-113698521-A Polypropylene copolymer, product and preparation method thereof 中国石化中原石油化工有限责任公司 2021-11-26 — — CN disclosed
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