SCHEMBL30825845

SCHEMBL30825845

CCCCCCCCCCCCCCOCCCO[Si](C)(C)C(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.44
MEN1 O00255 1/20 0.44
THRB P10828 1/20 0.44
KMT2A Q03164 1/20 0.44
MAPT P10636 1/20 0.44
ALDH1A1 P00352 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
CES2 O00748 2/20 0.38
CES1 P23141 1/20 0.38
USP2 O75604 1/20 0.35
DUT P33316 2/20 0.35
TSHR P16473 3/20 0.34
SPHK1 Q9NYA1 2/20 0.33
SPHK2 Q9NRA0 1/20 0.33

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
SCHEMBL27161205 0.92 DUT (0.38) HTTMEN1THRBKMT2AMAPT
SCHEMBL29928092 0.92 DUT (0.38) HTTMEN1THRBKMT2AMAPT
SCHEMBL31039441 0.92 DUT (0.38) HTTMEN1THRBKMT2AMAPT
SCHEMBL9671669 0.92 DUT (0.38) HTTMEN1THRBKMT2AMAPT
SCHEMBL18746891 0.92 DUT (0.38) HTTMEN1THRBKMT2AMAPT
SCHEMBL8076746 0.92 DUT (0.38) HTTMEN1THRBKMT2AMAPT
SCHEMBL13645501 0.92 DUT (0.38) HTTMEN1THRBKMT2AMAPT
SCHEMBL8072599 0.92 DUT (0.38) HTTMEN1THRBKMT2AMAPT
SCHEMBL5652054 0.92 DUT (0.38) HTTMEN1THRBKMT2AMAPT
SCHEMBL7535856 0.92 DUT (0.38) HTTMEN1THRBKMT2AMAPT

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-117858881-A Phospholipid compounds and methods of making and using the same 吉利德科学公司 2024-04-09 CN disclosed