SCHEMBL6861676

SCHEMBL6861676

O=C(Cl)OCC(OC(=O)Cl)C(COC(=O)Cl)OC(=O)Cl

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.35
ALDH1A1 P00352 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
SCHEMBL6864048 0.85 TDP1 (0.32) TDP1
SCHEMBL6857047 0.82 CA2 (0.38) TDP1ALDH1A1
SCHEMBL6230224 0.79 ALDH1A1 (0.35) ALDH1A1
SCHEMBL9390604 0.77 ALDH1A1 (0.31) ALDH1A1
SCHEMBL11054852 0.75 TSHR (0.35) ALDH1A1
SCHEMBL10714766 0.73 PRKCA (0.47)
SCHEMBL10716418 0.72 CYP1A2 (0.37) ALDH1A1
SCHEMBL1923101 0.72
SCHEMBL7809363 0.72 TSHR (0.42) TDP1ALDH1A1
SCHEMBL28359348 0.72 TSHR (0.33) ALDH1A1

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 3 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
US-5760149-A POLYMERIZATION INITIATORS, CURING AGENTS ELF ATOCHEM NORTH AMERICA, INC. (US) 1998-06-02 US disclosed