SCHEMBL28513732

SCHEMBL28513732

O=C(CCCCC(=O)CP(=O)(c1ccccc1)c1ccccc1)CP(=O)(c1ccccc1)c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.64
NPSR1 Q6W5P4 3/20 0.58
POLB P06746 2/20 0.55
ALDH1A1 P00352 4/20 0.50
GAA P10253 3/20 0.50
HTT P42858 2/20 0.50
MAPT P10636 1/20 0.50
ALPG P10696 1/20 0.50
ALOX12 P18054 1/20 0.50
NPY1R P25929 1/20 0.50
NPY2R P49146 1/20 0.50
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
CYP2C9 P11712 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.43
TDP1 Q9NUW8 1/20 0.42
CFTR P13569 1/20 0.42

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
SCHEMBL28663387 0.80 USP2 (0.64) USP2NPSR1POLBALDH1A1GAA
SCHEMBL9009717 0.79 USP2 (1.00) USP2NPSR1POLBALDH1A1GAA
SCHEMBL13239817 0.75 USP2 (0.69) USP2NPSR1POLBALDH1A1GAA
SCHEMBL22361763 0.75 USP2 (0.69) USP2NPSR1POLBALDH1A1GAA
SCHEMBL9463186 0.74 NPSR1 (0.96) USP2NPSR1POLBALDH1A1GAA
SCHEMBL28971881 0.73 USP2 (0.67) USP2NPSR1POLBALDH1A1GAA
SCHEMBL3504943 0.73 GAA (0.60) USP2NPSR1POLBALDH1A1GAA
SCHEMBL10780224 0.73 NPSR1 (1.00) USP2NPSR1POLBALDH1A1GAA
SCHEMBL8734179 0.73 POLB (0.60) USP2POLBALDH1A1GAAHTT
Oxalic Acid SCHEMBL8719358 0.72 USP2 (0.64) USP2NPSR1POLBALDH1A1GAA

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-112226635-B Uranyl ion separation method based on carboxyl functional ionic liquid 中国工程物理研究院核物理与化学研究所 2023-03-28 CN claimed
CN-112226635-A Uranyl ion separation method based on carboxyl functional ionic liquid 中国工程物理研究院核物理与化学研究所 2021-01-15 CN claimed
CN-112226635-B Uranyl ion separation method based on carboxyl functional ionic liquid 中国工程物理研究院核物理与化学研究所 2023-03-28 CN disclosed
CN-112226635-A Uranyl ion separation method based on carboxyl functional ionic liquid 中国工程物理研究院核物理与化学研究所 2021-01-15 CN disclosed