SCHEMBL28980331

SCHEMBL28980331

CC(CO[Si](C)(C)C(C)(C)C)N(CCCOS(C)(=O)=O)C(=O)OC(C)(C)C

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.31
USP2 O75604 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
MMP9 P14780 1/20 0.31
ALOX15 P16050 1/20 0.31
TSHR P16473 1/20 0.31

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
SCHEMBL28980328 1.00 KDM4E (0.31) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL28980352 0.80 MEN1 (0.30)
SCHEMBL567560 0.77
SCHEMBL4837241 0.72 AAK1 (0.31)
SCHEMBL4837235 0.72 AAK1 (0.31)
SCHEMBL6597526 0.71 KDM4E (0.41) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL6597532 0.71 KDM4E (0.41) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL28980349 0.71
SCHEMBL22536843 0.71
SCHEMBL17807224 0.70 DUT (0.34)

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-115925721-A Pyrimidone tricyclic derivative, preparation method, pharmaceutical composition and application thereof 上海赛默罗生物科技有限公司 2023-04-07 CN disclosed