SCHEMBL29196435

SCHEMBL29196435

CC(=COCCOCCOC=C(C)C(=O)O)C(=O)O

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.32
TSHR P16473 3/20 0.32
TP53 P04637 2/20 0.32
HIF1A Q16665 2/20 0.32
HSD17B10 Q99714 2/20 0.32
BLM P54132 1/20 0.31
PMP22 Q01453 1/20 0.31
PTGS1 P23219 1/20 0.30
AKR1C3 P42330 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
SCHEMBL28506569 0.93 PTGS1 (0.33) PTGS1AKR1C3
SCHEMBL715215 0.92 MEN1 (0.42) ALDH1A1TSHR
SCHEMBL2878687 0.92 ALDH1A1 (0.31) ALDH1A1
SCHEMBL6326770 0.92 ALDH1A1 (0.31) ALDH1A1
SCHEMBL8855779 0.92 ALDH1A1 (0.31) ALDH1A1
SCHEMBL502736 0.92 MEN1 (0.42) ALDH1A1TSHR
SCHEMBL714155 0.92 MEN1 (0.42) ALDH1A1TSHR
SCHEMBL2123382 0.92 MEN1 (0.42) ALDH1A1TSHR
SCHEMBL16616024 0.90 ALDH1A1 (0.35) ALDH1A1TSHRTP53HIF1AHSD17B10
SCHEMBL3082202 0.90 ALDH1A1 (0.47) ALDH1A1TSHRHSD17B10

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-117683176-A Preparation method of antibacterial nanocellulose super absorbent resin 杭州市化工研究院有限公司 2024-03-12 CN claimed