SCHEMBL17449488

SCHEMBL17449488

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

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.39
THRB P10828 1/20 0.34
HPGD P15428 1/20 0.32
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL17449489 0.91 TSHR (0.46) TSHRTHRBALDH1A1
SCHEMBL17449486 0.89 TSHR (0.40) TSHRTHRBHPGDALDH1A1
SCHEMBL17448870 0.87 TSHR (0.42) TSHRTHRBHPGDALDH1A1
SCHEMBL18080879 0.78 TSHR (0.50) TSHRTHRBHPGDALDH1A1
SCHEMBL21976107 0.76 TSHR (0.52) TSHRTHRBHPGDALDH1A1
SCHEMBL17448872 0.76 TSHR (0.52) TSHRTHRBALDH1A1
SCHEMBL17448871 0.76 TSHR (0.40) TSHRTHRBHPGDALDH1A1
SCHEMBL16132588 0.76 TSHR (0.40) TSHRALDH1A1
SCHEMBL176350 0.75 TSHR (0.50) TSHRTHRBHPGDALDH1A1
SCHEMBL700973 0.75 TSHR (0.50) TSHRTHRBHPGDALDH1A1

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