SCHEMBL29210010

SCHEMBL29210010

CC(=O)NC(=O)C(Cl)Cl.[Pd]

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 1/20 0.39
ALDH1A2 O94788 1/20 0.37
ALDH1A1 P00352 1/20 0.37
ALDH2 P05091 1/20 0.37
ALDH1A3 P47895 1/20 0.37
TAS2R38 P59533 1/20 0.36
KDM4E B2RXH2 1/20 0.33
CA2 P00918 1/20 0.33
PTGS1 P23219 1/20 0.33
MMP12 P39900 1/20 0.33
LMNA P02545 1/20 0.33
NFKB1 P19838 1/20 0.32
EPHX1 P07099 1/20 0.31
KMT2A Q03164 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
SCHEMBL6963765 0.97
SCHEMBL11261588 0.78
SCHEMBL11319968 0.76 ALDH1A1 (0.45) CRBNALDH1A1TAS2R38KDM4ECA2
SCHEMBL11261611 0.72 CRBN (0.35) CRBNALDH1A1TAS2R38
SCHEMBL2220319 0.71
SCHEMBL6971176 0.71
SCHEMBL10942414 0.71 CRBN (0.43) CRBNALDH1A1TAS2R38KDM4ECA2
SCHEMBL6971181 0.71
SCHEMBL28659714 0.69
SCHEMBL6517566 0.69

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-117384221-B Palladium oxalate compound, and preparation method and application thereof 贵研化学材料(云南)有限公司 2024-05-07 CN disclosed
CN-117384221-A Palladium oxalate compound, and preparation method and application thereof 贵研化学材料(云南)有限公司 2024-01-12 CN disclosed