SCHEMBL28954239

SCHEMBL28954239

C(=C(C1CCCCC1)C1CCCCC1)C1CCCCC1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.39
CES1 P23141 1/20 0.39
MGLL Q99685 1/20 0.35
GRIK1 P39086 2/20 0.33
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.32
NOS2 P35228 1/20 0.32
GRIK2 Q13002 1/20 0.31

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
SCHEMBL15703261 1.00 CES2 (0.39) CES2CES1MGLLGRIK1HDAC8
SCHEMBL18800252 0.85 TSHR (0.39) CES2CES1MGLLTSHR
SCHEMBL9185124 0.74 CES2 (0.36) CES2CES1MGLLGRIK1HDAC8
SCHEMBL9173380 0.71 CES2 (0.43) CES2CES1MGLLHDAC8HDAC6
SCHEMBL27776497 0.71 CES2 (0.43) CES2CES1MGLLHDAC8HDAC6
SCHEMBL5088912 0.71 GRIK1 (0.35) CES2CES1GRIK1TSHRGRIK2
SCHEMBL16528332 0.70 GRIK1 (0.44) CES2CES1GRIK1HDAC8HDAC6
SCHEMBL7159243 0.70 GRIK1 (0.44) CES2CES1GRIK1HDAC8HDAC6
SCHEMBL865420 0.70 GRIK1 (0.44) CES2CES1GRIK1HDAC8HDAC6
SCHEMBL27264894 0.70 CES2 (0.32) CES2CES1NOS2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114829477-B Optically bonded silicones with UV blockers for outdoor applications 瓦克化学股份公司 2024-04-12 CN disclosed
CN-114829477-A Optically adhesive silicones with UV blockers for outdoor applications 瓦克化学股份公司 2022-07-29 CN disclosed