SCHEMBL30727013

SCHEMBL30727013

CCCCCCCCOC[Si](OC)(OC)OC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.45
THRB P10828 2/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
MAPT P10636 1/20 0.45
LMNA P02545 1/20 0.42
CES2 O00748 2/20 0.42
LPAR2 Q9HBW0 7/20 0.41
LPAR3 Q9UBY5 7/20 0.41
LPAR1 Q92633 4/20 0.41
LPAR6 P43657 3/20 0.41
LPAR4 Q99677 3/20 0.41
LPAR5 Q9H1C0 3/20 0.41
ALDH1A1 P00352 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
USP2 O75604 1/20 0.39
CES1 P23141 1/20 0.38
PRKD3 O94806 1/20 0.38
PRKCG P05129 1/20 0.38
PRKCB P05771 1/20 0.38

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
SCHEMBL30727001 1.00 HTT (0.45) HTTTHRBMEN1KMT2AMAPT
SCHEMBL30726995 1.00 HTT (0.45) HTTTHRBMEN1KMT2AMAPT
SCHEMBL29155588 1.00 HTT (0.45) HTTTHRBMEN1KMT2AMAPT
SCHEMBL29155600 1.00 HTT (0.45) HTTTHRBMEN1KMT2AMAPT
SCHEMBL29155594 1.00 HTT (0.45) HTTTHRBMEN1KMT2AMAPT
SCHEMBL29155583 1.00 HTT (0.45) HTTTHRBMEN1KMT2AMAPT
SCHEMBL29155576 1.00 HTT (0.45) HTTTHRBMEN1KMT2AMAPT
SCHEMBL30727033 1.00 HTT (0.45) HTTTHRBMEN1KMT2AMAPT
SCHEMBL29155598 1.00 HTT (0.45) HTTTHRBMEN1KMT2AMAPT
SCHEMBL29155575 1.00 HTT (0.45) HTTTHRBMEN1KMT2AMAPT

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-117529524-A Curable composition and cured product 综研化学株式会社 2024-02-06 CN disclosed