SCHEMBL28423751

SCHEMBL28423751

CC(O)=S.CCCCCCCC[SiH2]OC(=O)CCCCCCCCCCCCCCCCC(C)C

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.43
MAPT P10636 2/20 0.40
PAM P19021 2/20 0.39
FFAR4 Q5NUL3 1/20 0.39
FFAR1 O14842 1/20 0.39
DGKA P23743 1/20 0.38
MAPK1 P28482 1/20 0.38
CETP P11597 1/20 0.37
TLR2 O60603 1/20 0.36
ALDH1A1 P00352 1/20 0.36
ACE2 Q9BYF1 1/20 0.36
KDM4E B2RXH2 1/20 0.35
DUSP3 P51452 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL28419924 1.00 LMNA (0.43) LMNAMAPTPAMFFAR4FFAR1
SCHEMBL28891724 0.93 LMNA (0.49) LMNAMAPTPAMFFAR4FFAR1
SCHEMBL28416480 0.93 LMNA (0.49) LMNAMAPTPAMFFAR4FFAR1
SCHEMBL28419000 0.93 LMNA (0.49) LMNAMAPTPAMFFAR4FFAR1
SCHEMBL28423840 0.89 LMNA (0.46) LMNAMAPTPAMFFAR4FFAR1
SCHEMBL28423799 0.87 LMNA (0.38) LMNAMAPTPAMFFAR4FFAR1
SCHEMBL28419949 0.87 LMNA (0.38) LMNAMAPTPAMFFAR4FFAR1
SCHEMBL28428186 0.80 FOLH1 (0.35) LMNAMAPTCETPTLR2MEN1
SCHEMBL6663763 0.79 DGKA (0.48) LMNAMAPTPAMDGKAMAPK1
SCHEMBL6662620 0.79 DGKA (0.48) LMNAMAPTPAMDGKAMAPK1

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-111233916-A Long carbon chain sulfur-containing silane coupling agent, and preparation method and application thereof 南京曙光精细化工有限公司 2020-06-05 CN disclosed