SCHEMBL17449489

SCHEMBL17449489

C=C(C)C(=O)OCC(COC(=O)C(=C)C)OCP(=O)(OCC)OCC

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.46
THRB P10828 1/20 0.40
ALDH1A1 P00352 1/20 0.35
PPARD Q03181 1/20 0.33
MAPT P10636 1/20 0.31
MAPK1 P28482 1/20 0.31

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
SCHEMBL17449488 0.91 TSHR (0.39) TSHRTHRBALDH1A1
SCHEMBL17448872 0.84 TSHR (0.52) TSHRTHRBALDH1A1
SCHEMBL17449486 0.83 TSHR (0.40) TSHRTHRBALDH1A1
SCHEMBL5164791 0.82 THRB (0.48) TSHRTHRBALDH1A1PPARDMAPT
SCHEMBL15032673 0.78 TSHR (0.49) TSHRTHRBALDH1A1PPARDMAPT
SCHEMBL15674069 0.77 TSHR (0.47) TSHRTHRBALDH1A1PPARDMAPT
SCHEMBL17448870 0.75 TSHR (0.42) TSHRTHRBALDH1A1
SCHEMBL14955789 0.74 THRB (0.44) TSHRTHRBALDH1A1PPARDMAPT
SCHEMBL10939402 0.74 TSHR (0.55) TSHRTHRBALDH1A1
SCHEMBL31454007 0.74 TSHR (0.56) TSHRTHRBALDH1A1PPARDMAPT

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-20160017170-A1 PHOTOCURABLE COMPOSITION AND ENVELOPED DEVICE INCLUDING SAME CHEIL INDUSTRIES INC. (KR) 2016-01-21 US disclosed