SCHEMBL28280640

SCHEMBL28280640

C=C(C(=O)OC)C(C)C.C=C(C)C(=O)OCCCCCCCCCCCCC

nearest known ligand 0.71

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.71
RAD52 P43351 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
EPHX1 P07099 1/20 0.42
THRB P10828 1/20 0.42
POLB P06746 1/20 0.42
APEX1 P27695 1/20 0.42
HTT P42858 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
NAAA Q02083 1/20 0.41
ALDH1A1 P00352 1/20 0.40
FAAH O00519 1/20 0.39
ACHE P22303 6/20 0.38
ZDHHC7 Q9NXF8 1/20 0.37

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
SCHEMBL11398908 0.90 TSHR (0.65) TSHRRAD52NPSR1EPHX1THRB
SCHEMBL3190827 0.88 TSHR (0.86) TSHRRAD52NPSR1EPHX1THRB
SCHEMBL7089029 0.88 TSHR (0.86) TSHRRAD52NPSR1EPHX1THRB
SCHEMBL18221812 0.88 TSHR (0.86) TSHRRAD52NPSR1EPHX1THRB
SCHEMBL2060012 0.88 TSHR (0.86) TSHRRAD52NPSR1EPHX1THRB
SCHEMBL7535600 0.88 TSHR (0.86) TSHRRAD52NPSR1EPHX1THRB
SCHEMBL9299625 0.88 TSHR (0.86) TSHRRAD52NPSR1EPHX1THRB
SCHEMBL29096240 0.86 TSHR (0.65) TSHRRAD52NPSR1EPHX1NAAA
SCHEMBL1069127 0.86 TSHR (0.65) TSHRRAD52NPSR1EPHX1NAAA
SCHEMBL13266339 0.86 TSHR (0.65) TSHRRAD52NPSR1EPHX1NAAA

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-109476960-A Reinforcing film with separator 日东电工株式会社 2019-03-15 CN disclosed