SCHEMBL29035595

SCHEMBL29035595

CCOC(CCC(=O)OC(C)(C)C)(OCC)OCC.[Zr]

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 2/20 0.32
HDAC2 Q92769 2/20 0.32
HDAC6 Q9UBN7 2/20 0.32
HDAC3 O15379 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
STING1 Q86WV6 1/20 0.31
EPHX2 P34913 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
SCHEMBL19147779 0.82 HDAC6 (0.33) HDAC1HDAC2HDAC6HDAC3HDAC8
SCHEMBL1263504 0.79 HDAC1 (0.34) HDAC1HDAC2HDAC6HDAC3HDAC8
SCHEMBL2208577 0.78 CYP1A2 (0.47)
SCHEMBL5201745 0.77 CYP1A2 (0.32)
SCHEMBL16327485 0.74 HDAC6 (0.37) HDAC1HDAC2HDAC6HDAC3HDAC8
SCHEMBL10014001 0.74 HDAC6 (0.37) HDAC1HDAC2HDAC6HDAC3HDAC8
SCHEMBL18022726 0.74 HDAC1 (0.34) HDAC1HDAC2HDAC6HDAC3HDAC8
SCHEMBL644646 0.73 TSHR (0.45) HDAC1HDAC2HDAC6HDAC3HDAC8
SCHEMBL28513604 0.73 CYP2D6 (0.33)
SCHEMBL28565057 0.73 ALDH1A1 (0.43) HDAC1HDAC2HDAC3HDAC8

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-109716491-B Method for manufacturing field effect transistor and method for manufacturing wireless communication device 东丽株式会社 2023-06-09 CN disclosed