SCHEMBL28423769

SCHEMBL28423769

CCCCCCCCCCCCCCCCCC(=O)O[Si](CCCCCC)(OC)OC(=O)CCCCCCCCCCCCCCCCC.OC=S

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.42
TSHR P16473 1/20 0.41
LMNA P02545 3/20 0.40
POLB P06746 1/20 0.40
POLA1 P09884 1/20 0.40
PAM P19021 2/20 0.39
ENPP2 Q13822 5/20 0.39
LPAR3 Q9UBY5 4/20 0.39
LPAR6 P43657 3/20 0.39
LPAR1 Q92633 3/20 0.39
LPAR4 Q99677 3/20 0.39
LPAR5 Q9H1C0 3/20 0.39
LPAR2 Q9HBW0 3/20 0.39
MAPT P10636 2/20 0.38
MAPK1 P28482 1/20 0.38
EPHX2 P34913 1/20 0.38
RECQL P46063 1/20 0.37
BLM P54132 1/20 0.37
TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL12504369 0.87 DGKA (0.46) DGKATSHRLMNAPOLBPOLA1
SCHEMBL12504320 0.82 LMNA (0.43) DGKATSHRLMNAPOLBPOLA1
SCHEMBL12504184 0.79 DGKA (0.38) DGKATSHRLMNAPAMLPAR3
SCHEMBL12504523 0.76 DGKA (0.44) DGKATSHRLMNAPAMMAPT
SCHEMBL31506233 0.75 DGKA (0.62) DGKATSHRLMNAPAMMAPT
SCHEMBL31506245 0.75 DGKA (0.62) DGKATSHRLMNAPAMMAPT
SCHEMBL31506254 0.75 DGKA (0.62) DGKATSHRLMNAPAMMAPT
SCHEMBL31506308 0.75 DGKA (0.62) DGKATSHRLMNAPAMMAPT
SCHEMBL6243474 0.75 DGKA (0.55) DGKATSHRLMNAPAMMAPT
SCHEMBL22398871 0.74 TSHR (0.35) DGKATSHRLMNAPAMMAPT

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