SCHEMBL6695785

SCHEMBL6695785

C=C(C)C(=O)OC(C)C(=O)C(=C)C

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.45
ALDH1A1 P00352 2/20 0.44
THRB P10828 1/20 0.33
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL16169939 0.86 TSHR (0.42) TSHRALDH1A1THRB
SCHEMBL9323497 0.83 TSHR (0.46) TSHRALDH1A1THRBTDP1
SCHEMBL1755554 0.83 TSHR (0.46) TSHRALDH1A1THRBTDP1
SCHEMBL28080157 0.83 TSHR (0.48) TSHRALDH1A1TDP1
SCHEMBL5249209 0.83 TSHR (0.46) TSHRALDH1A1THRBTDP1
Lithium Ion SCHEMBL18139256 0.82 TSHR (0.42) TSHRALDH1A1THRB
Potassium Ion SCHEMBL18139732 0.82 TSHR (0.42) TSHRALDH1A1THRB
SCHEMBL18140856 0.82 TSHR (0.42) TSHRALDH1A1THRB
SCHEMBL18139187 0.82 TSHR (0.42) TSHRALDH1A1THRB
SCHEMBL18139985 0.82 TSHR (0.42) TSHRALDH1A1THRB

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
US-20040009426-A1 Photopolymerizable monomers hardenable by an infrared exposure; electrostatic capacitance rate of increased ratio of such photosensitive formulation, is no more than 0.7 FUJI PHOTO FILM CO., LTD. 2004-01-15 US disclosed
EP-1369231-A2 Infrared photosensitive composition and image recording material for infrared exposure FUJI PHOTO FILM CO., LTD. (JP) 2003-12-10 EP disclosed