SCHEMBL31362744

SCHEMBL31362744

CC(CO)CC(CO)NC(N)=O

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 2/20 0.34
TAS1R3 Q7RTX0 1/20 0.33
TAS1R1 Q7RTX1 1/20 0.33
MMP2 P08253 2/20 0.32
MMP9 P14780 2/20 0.32
MMP12 P39900 2/20 0.32
NPC1 O15118 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TGFBR1 P36897 1/20 0.31
CYP3A4 P08684 1/20 0.31
MAPK1 P28482 1/20 0.31
AURKA O14965 1/20 0.30
AURKB Q96GD4 1/20 0.30
CAD P27708 1/20 0.30
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
SCHEMBL27790425 0.85 TAS1R3 (0.43) TAS1R3TAS1R1ALDH1A1AURKAAURKB
SCHEMBL16515197 0.81 TRPA1 (0.39) TRPA1MMP2MMP9MMP12ALDH1A1
SCHEMBL15872915 0.81 TRPA1 (0.39) TRPA1MMP2MMP9MMP12ALDH1A1
SCHEMBL16515196 0.81 TRPA1 (0.39) TRPA1MMP2MMP9MMP12ALDH1A1
SCHEMBL1526165 0.79
SCHEMBL6248082 0.76
SCHEMBL31362770 0.73 TAS1R3 (0.33) TAS1R3TAS1R1ALDH1A1CADTSHR
SCHEMBL27574600 0.73 SLC7A5 (0.41) NPC1ALDH1A1
SCHEMBL12119817 0.72 CA1 (0.47)
SCHEMBL1552535 0.72 CA1 (0.47)

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-119098067-A Method for producing reverse osmosis membrane and reverse osmosis membrane produced thereby 沃顿科技股份有限公司 2024-12-10 CN disclosed