SCHEMBL29066985

SCHEMBL29066985

CCCCO[Si](CC)(OCC)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.41
CYP1A2 P05177 2/20 0.36
CYP2C9 P11712 2/20 0.36
CYP2C19 P33261 2/20 0.36
ABCB1 P08183 1/20 0.35
TSHR P16473 4/20 0.35
L3MBTL1 Q9Y468 4/20 0.35
TDP1 Q9NUW8 2/20 0.35
CYP2D6 P10635 1/20 0.35
CYP19A1 P11511 1/20 0.35
MAPT P10636 2/20 0.33
FGFR1 P11362 1/20 0.33
TP53 P04637 1/20 0.33
ALDH1A1 P00352 4/20 0.33
TLR8 Q9NR97 1/20 0.33
CYP3A4 P08684 1/20 0.33
MAPK1 P28482 1/20 0.33
LMNA P02545 2/20 0.32
MEN1 O00255 1/20 0.32
GLA P06280 1/20 0.32

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
SCHEMBL706387 0.95 LTA4H (0.44) LTA4HCYP1A2CYP2C9CYP2C19ABCB1
SCHEMBL19809285 0.89 LTA4H (0.44) LTA4HABCB1TSHRTP53ALDH1A1
SCHEMBL19809337 0.89 LMNA (0.34) LTA4HALDH1A1LMNAMEN1GAA
SCHEMBL29066979 0.88 LTA4H (0.40) LTA4HCYP1A2CYP2C9CYP2C19ABCB1
SCHEMBL115876 0.87 LTA4H (0.34) LTA4HTSHRL3MBTL1MAPTTP53
SCHEMBL705317 0.85 CYP2D6 (0.37) LTA4HCYP1A2CYP2C9CYP2C19TSHR
SCHEMBL706144 0.84 LTA4H (0.44) LTA4HCYP1A2CYP2C9CYP2C19ABCB1
SCHEMBL706157 0.84 LTA4H (0.44) LTA4HCYP1A2CYP2C9CYP2C19ABCB1
SCHEMBL706072 0.83 LMNA (0.37) LTA4HFGFR1TP53ALDH1A1TLR8
SCHEMBL710735 0.82 LTA4H (0.43) LTA4HCYP1A2CYP2C9CYP2C19ABCB1

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-115181223-B Low-gloss matte auxiliary agent, preparation method thereof and molded body 铨盛聚碳科技股份有限公司 2023-08-29 CN disclosed