SCHEMBL8504615

SCHEMBL8504615

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

nearest known ligand 0.55

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.55
ALDH1A1 P00352 2/20 0.50
THRB P10828 1/20 0.35

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
SCHEMBL8503917 0.95 TSHR (0.50) TSHRALDH1A1THRB
SCHEMBL7261409 0.92 TSHR (0.59) TSHRALDH1A1THRB
SCHEMBL7760377 0.87 TSHR (0.57) TSHRALDH1A1THRB
SCHEMBL160208 0.86 TSHR (0.73) TSHRALDH1A1THRB
SCHEMBL16803291 0.86 TSHR (0.67) TSHRALDH1A1THRB
SCHEMBL17942956 0.86 TSHR (0.52) TSHRALDH1A1THRB
SCHEMBL8500979 0.85 TSHR (0.66) TSHRALDH1A1THRB
Water SCHEMBL7715061 0.85 TSHR (0.70) TSHRALDH1A1THRB
Ethylene SCHEMBL2156738 0.85 TSHR (0.70) TSHRALDH1A1THRB
SCHEMBL2612002 0.85 TSHR (0.59) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0896340-A1 GEL-FORM SOLID POLYMER ELECTROLYTE Mitsui Chemicals, Inc. (JP) 1999-02-10 EP disclosed