SCHEMBL6678643

SCHEMBL6678643

CCN(O)C(C)(N(O)CC)N(O)CC

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL8355412 0.79
SCHEMBL28006467 0.76
SCHEMBL19432675 0.73
SCHEMBL8771261 0.73 TSHR (0.33)
SCHEMBL28138433 0.71
SCHEMBL6680216 0.69
SCHEMBL6562033 0.67 TSHR (0.36) ALDH1A1
SCHEMBL27282793 0.66 TSHR (0.41) ALDH1A1
Chloromethane SCHEMBL5618722 0.65
SCHEMBL857506 0.62

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
US-20040204522-A1 Thermal stabilizer compositions for halogen-containing vinyl polymers AUSTEN STEVEN CHRISTOPHER (US) 2004-10-14 US claimed
EP-1466941-A2 Thermal stabilizer compositions for halogen-containing vinyl polymers ROHM AND HAAS COMPANY (US) 2004-10-13 EP claimed