SCHEMBL20664205

SCHEMBL20664205

CC(C)(C)C(=O)ON[S+]([O-])c1sccc1Br

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
POLB P06746 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
SCHEMBL20664198 0.84 POLB (0.32) POLB
SCHEMBL20664169 0.68 F2 (0.34) ALDH1A1POLB
SCHEMBL28090478 0.59 PDK1 (0.46) ALDH1A1
SCHEMBL399916 0.58 METAP1 (0.43)
SCHEMBL5725289 0.57 POLB (0.46) ALDH1A1POLB
SCHEMBL318317 0.57 KMT2A (0.54) ALDH1A1POLB
SCHEMBL1925308 0.56 MAPT (0.45) POLB
SCHEMBL28109284 0.56 RIPK1 (0.52) ALDH1A1POLB
SCHEMBL13990519 0.56 POLB (0.32) POLB
Pivalate SCHEMBL15953987 0.56 LMNA (0.40) ALDH1A1POLB

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-2509941-B1 N-ACYLATED HYDROXYLAMINE DERIVATIVES AND O-ACYLATED HYDROXYLAMINE DERIVATIVES UNIV JOHNS HOPKINS (US) 2019-01-23 EP disclosed