SCHEMBL28900147

SCHEMBL28900147

CCC(=O)CC(=O)CCCC(=O)CC=O

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.36
HAO1 Q9UJM8 1/20 0.34
FNTA P49354 1/20 0.32
FNTB P49356 1/20 0.32
KDM4E B2RXH2 1/20 0.31
KDM6B O15054 1/20 0.31
KDM5C P41229 1/20 0.31
EGLN1 Q9GZT9 1/20 0.31
PHF8 Q9UPP1 1/20 0.31
KDM2A Q9Y2K7 1/20 0.31
TSHR P16473 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
SCHEMBL28460206 0.81 HAO1 (0.44) HAO1TSHR
SCHEMBL29241906 0.81 KDM4E (0.52) HAO1FNTAFNTBKDM4EKDM6B
SCHEMBL29064776 0.80 TDP1 (0.45) TDP1KDM4EKDM6BKDM5CEGLN1
SCHEMBL23209773 0.79 TSHR (0.43) TDP1HAO1TSHR
SCHEMBL7266153 0.79 KDM4E (0.40) HAO1FNTAFNTBKDM4EKDM6B
SCHEMBL1163791 0.78
SCHEMBL26136419 0.78 HAO1 (0.50) TDP1HAO1TSHR
SCHEMBL28611931 0.77 MAPT (0.39) HAO1FNTAFNTBTSHR
SCHEMBL942047 0.77
SCHEMBL7260519 0.76 CES2 (0.38) TDP1HAO1KDM4EKDM6BKDM5C

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-115420830-B GC-MS method for quantitatively detecting volatile components of golden bell oral liquid 山东宏济堂制药集团股份有限公司 2023-06-23 CN claimed
CN-115420830-A GC-MS method for quantitatively detecting volatile components of golden scallop oral liquid 山东宏济堂制药集团股份有限公司 2022-12-02 CN claimed
CN-115420830-B GC-MS method for quantitatively detecting volatile components of golden bell oral liquid 山东宏济堂制药集团股份有限公司 2023-06-23 CN disclosed
CN-115420830-A GC-MS method for quantitatively detecting volatile components of golden scallop oral liquid 山东宏济堂制药集团股份有限公司 2022-12-02 CN disclosed