SCHEMBL28222599

SCHEMBL28222599

O=CN[C@@H](CCC(=O)OCc1ccccc1)C(=O)OCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.48
▸ MEN1 O00255 2/20 0.48
▸ KMT2A Q03164 2/20 0.48
▸ HPGD P15428 1/20 0.48
▸ MAPK1 P28482 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ LMNA P02545 1/20 0.44
▸ CDC25B P30305 1/20 0.44
▸ FOLH1 Q04609 1/20 0.43
▸ TACR1 P25103 1/20 0.42
▸ CASP1 P29466 1/20 0.42
▸ ACE P12821 1/20 0.42
▸ CCKBR P32239 2/20 0.41
▸ POLB P06746 2/20 0.41
▸ MAPT P10636 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ HCAR2 Q8TDS4 1/20 0.41
▸ CTSB P07858 1/20 0.41

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
SCHEMBL13996825 1.00 ALDH1A1 (0.48) ALDH1A1MEN1KMT2AHPGDMAPK1
SCHEMBL26047547 0.92 ALDH1A1 (0.49) ALDH1A1MEN1KMT2AHPGDMAPK1
SCHEMBL27312654 0.92 FOLH1 (0.49) ALDH1A1MEN1KMT2AHPGDMAPK1
SCHEMBL22300310 0.91 ALDH1A1 (0.49) ALDH1A1MEN1KMT2AHPGDMAPK1
SCHEMBL8256369 0.90 FOLH1 (0.53) ALDH1A1FOLH1TACR1ACE
SCHEMBL7046382 0.88 POLB (0.45) ALDH1A1KMT2AFOLH1TACR1ACE
SCHEMBL24591318 0.87 ALDH1A1 (0.46) ALDH1A1MEN1KMT2AHPGDMAPK1
SCHEMBL23446366 0.87 KMT2A (0.46) ALDH1A1MEN1KMT2AHPGDMAPK1
SCHEMBL23475284 0.86 MEN1 (0.53) ALDH1A1MEN1KMT2AHPGDCASP1
SCHEMBL27847367 0.86 ALDH1A1 (0.50) ALDH1A1MEN1KMT2AHPGDMAPK1

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
CN-110483764-A Charge drives the anti-oxidant nanoparticle of self assembly and its application as fruit and vegetable fresh-keeping agent and lichee fresh-keeping UNIV WENZHOU MEDICAL 2019-11-22 — — CN claimed
CN-110483764-A Charge drives the anti-oxidant nanoparticle of self assembly and its application as fruit and vegetable fresh-keeping agent and lichee fresh-keeping UNIV WENZHOU MEDICAL 2019-11-22 — — CN disclosed
CN-110483764-A Charge drives the anti-oxidant nanoparticle of self assembly and its application as fruit and vegetable fresh-keeping agent and lichee fresh-keeping UNIV WENZHOU MEDICAL 2019-11-22 — — CN disclosed
CN-108210932-A A kind of preparation method of charge driving self-assembly chitosan base medicine-carried nano particles 温州医科大学 2018-06-29 — — CN disclosed
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