SCHEMBL6339685

SCHEMBL6339685

C=C(C)C(=O)OCCO.CCCCCCOCCCCCC

nearest known ligand 0.74

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.74
THRB P10828 2/20 0.56
HTT P42858 2/20 0.56
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
MAPT P10636 1/20 0.56
CES2 O00748 2/20 0.49
POLB P06746 1/20 0.42
APEX1 P27695 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
NAAA Q02083 1/20 0.42
ACHE P22303 1/20 0.41
RAD52 P43351 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
EPHX1 P07099 1/20 0.40
PLA2G2C Q5R387 1/20 0.39
USP2 O75604 1/20 0.39

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
SCHEMBL4969152 0.94 TSHR (0.70) TSHRTHRBHTTMEN1KMT2A
Di(Hydroxyethyl)Ether SCHEMBL27625390 0.93 TSHR (0.80) TSHRTHRBHTTMEN1KMT2A
SCHEMBL7198622 0.93 TSHR (0.86) TSHRTHRBHTTMEN1KMT2A
SCHEMBL28738829 0.93 TSHR (0.86) TSHRTHRBHTTMEN1KMT2A
SCHEMBL4967751 0.93 TSHR (0.62) TSHRTHRBHTTMEN1KMT2A
SCHEMBL11402168 0.93 TSHR (0.86) TSHRTHRBHTTMEN1KMT2A
SCHEMBL8007369 0.93 TSHR (0.86) TSHRTHRBHTTMEN1KMT2A
SCHEMBL4053226 0.93 TSHR (0.86) TSHRTHRBHTTMEN1KMT2A
Butoxyethanol SCHEMBL28213660 0.92 TSHR (0.61) TSHRTHRBHTTMEN1KMT2A
SCHEMBL11239487 0.91 TSHR (0.89) TSHRTHRBHTTMEN1KMT2A

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
US-6863973-B2 Fiber-reinforced plastic molded article, its production method and a molding mold using that method DAINIPPON INK AND CHEMICALS, INC. (JP) 2005-03-08 US disclosed