SCHEMBL28309765

SCHEMBL28309765

CC(=O)C(=O)CNC(N)=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 1/20 0.38
TDP1 Q9NUW8 1/20 0.36
LMNA P02545 3/20 0.35
BLM P54132 2/20 0.35
PMP22 Q01453 2/20 0.35
ALOX15 P16050 1/20 0.35
CES1 P23141 1/20 0.33
TSHR P16473 4/20 0.32
NFKB1 P19838 2/20 0.32
CA4 P22748 2/20 0.32
THPO P40225 2/20 0.32
CYP1A2 P05177 1/20 0.32
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
CA2 P00918 1/20 0.32
CYP3A4 P08684 1/20 0.32
CA5A P35218 1/20 0.32
CA9 Q16790 1/20 0.32
ALDH1A1 P00352 1/20 0.31
CYP2C9 P11712 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
SCHEMBL5148714 0.78
SCHEMBL13410473 0.78 KDM4E (0.43) CES1TSHRNFKB1CA4THPO
SCHEMBL7081593 0.78
SCHEMBL4811397 0.74
Water SCHEMBL8624719 0.74 CA2 (0.44) TDP1LMNABLMPMP22TSHR
SCHEMBL6290138 0.74
SCHEMBL28111980 0.72
Water SCHEMBL27998214 0.72
SCHEMBL17256651 0.72 KDM4E (0.41) CRBNTDP1LMNABLMPMP22
SCHEMBL6279657 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109939243-A Copper cluster, thymine modified hyaluronic acid and poly-copper cluster, and preparation method and application thereof 深圳广行科学研究有限公司 2019-06-28 CN disclosed