SCHEMBL6863549

SCHEMBL6863549

CCC(COC(=O)OOC(C)(C)CCC(C)(C)OOC(C)(C)C)(COC(=O)OOC(C)(C)CCC(C)(C)OOC(C)(C)C)COC(=O)OOC(C)(C)CCC(C)(C)OOC(C)(C)C

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.31
ALDH1A1 P00352 1/20 0.31
TSHR P16473 1/20 0.31
HSD17B10 Q99714 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL7060351 0.87 LMNA (0.37) THRBHSD17B10
SCHEMBL6863766 0.86 ALDH1A1 (0.36) THRBALDH1A1TSHRHSD17B10TDP1
SCHEMBL7052751 0.85 LMNA (0.36) THRBALDH1A1HSD17B10
SCHEMBL6861397 0.84 THRB (0.35) THRBALDH1A1TSHRTDP1
SCHEMBL7050962 0.84 ALDH1A1 (0.35) THRBALDH1A1TSHRHSD17B10TDP1
SCHEMBL7058407 0.83 THRB (0.34) THRBALDH1A1
SCHEMBL7052314 0.80 ALDH1A1 (0.36) THRBALDH1A1TSHRHSD17B10TDP1
SCHEMBL7058931 0.80 THRB (0.33) THRB
SCHEMBL4653862 0.79 ALDH1A1 (0.31) ALDH1A1TSHRTDP1
SCHEMBL7057794 0.79 THRB (0.32) THRBALDH1A1

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
EP-1382596-A1 Novel poly (monoperoxycarbonates) Atofina Chemicals, Inc. (US) 2004-01-21 EP disclosed
EP-0879224-B1 NOVEL POLY(MONOPEROXYCARBONATES) ATOFINA CHEM INC (US) 2003-10-22 EP disclosed