SCHEMBL28286997

SCHEMBL28286997

CCCCCCCCCCCCCCCCCC(=O)O[Si](OCC)(OCC)OCC.[MgH2]

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.50
LMNA P02545 3/20 0.47
PAM P19021 2/20 0.46
MAPT P10636 2/20 0.44
MAPK1 P28482 1/20 0.44
CES2 O00748 3/20 0.43
CES1 P23141 3/20 0.43
TSHR P16473 3/20 0.43
HSP90AA1 P07900 1/20 0.42
ALDH1A1 P00352 2/20 0.42
DNM1 Q05193 1/20 0.42
NAAA Q02083 1/20 0.42
PPARG P37231 3/20 0.42
PPARD Q03181 3/20 0.42
PPARA Q07869 3/20 0.42
GPR84 Q9NQS5 2/20 0.42
HDAC11 Q96DB2 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
SLC22A6 Q4U2R8 1/20 0.42
SLC22A8 Q8TCC7 1/20 0.42

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
SCHEMBL29168774 0.98 DGKA (0.52) DGKALMNAPAMMAPTMAPK1
SCHEMBL1517686 0.98 DGKA (0.52) DGKALMNAPAMMAPTMAPK1
SCHEMBL28293756 0.96 DGKA (0.50) DGKALMNAPAMMAPTMAPK1
SCHEMBL5178804 0.96 DGKA (0.48) DGKALMNAPAMMAPTMAPK1
SCHEMBL6243475 0.94 DGKA (0.52) DGKALMNAPAMMAPTMAPK1
SCHEMBL28026117 0.90 CES1 (0.41) DGKALMNAPAMMAPTMAPK1
SCHEMBL8679524 0.86 DGKA (0.59) DGKALMNAPAMMAPTMAPK1
SCHEMBL28735578 0.84 DGKA (0.53) DGKALMNAPAMMAPTMAPK1
SCHEMBL3918624 0.82 ALDH1A1 (0.48) DGKALMNACES2CES1TSHR
SCHEMBL9012985 0.81 CYP1A2 (0.50) DGKALMNAPAMMAPTTSHR

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-109705498-A Heat-resistant antifriction PVC plastic 南通壹选工业设计有限公司 2019-05-03 CN disclosed