SCHEMBL8041966

SCHEMBL8041966

C[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)C(Br)Br

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.32
ALDH1A1 P00352 1/20 0.31
LMNA P02545 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
SCHEMBL9742523 0.97 TDP1 (0.33) TDP1ALDH1A1LMNA
SCHEMBL4602034 0.86
SCHEMBL7176079 0.82 ALDH1A1 (0.46) TDP1ALDH1A1LMNA
SCHEMBL12337408 0.82 ALDH1A1 (0.46) TDP1ALDH1A1LMNA
SCHEMBL14543779 0.82 ALDH1A1 (0.46) TDP1ALDH1A1LMNA
SCHEMBL12807993 0.82 ALDH1A1 (0.46) TDP1ALDH1A1LMNA
SCHEMBL13500249 0.82 ALDH1A1 (0.46) TDP1ALDH1A1LMNA
SCHEMBL10070710 0.82 ALDH1A1 (0.46) TDP1ALDH1A1LMNA
SCHEMBL18532511 0.82 ALDH1A1 (0.46) TDP1ALDH1A1LMNA
SCHEMBL3649911 0.82 ALDH1A1 (0.46) TDP1ALDH1A1LMNA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0993304-A1 PHARMACEUTICAL COMPOSITION HAVING ENHANCED ANTITUMOR ACTIVITY AND/OR REDUCED SIDE EFFECTS, CONTAINING AN ANTITUMOR AGENT AND AN HYDROXAMIC ACID DERIVATIVE N-Gene Research Laboratories Inc. (US) 2000-04-19 EP disclosed
WO-1998058676-A1 PHARMACEUTICAL COMPOSITION HAVING ENHANCED ANTITUMOR ACTIVITY AND/OR REDUCED SIDE EFFECTS, CONTAINING AN ANTITUMOR AGENT AND AN HYDROXAMIC ACID DERIVATIVE N-GENE RESEARCH LABORATORIES INC. (US) 1998-12-30 WO disclosed
EP-0829104-A1 HIGH ENERGY DENSITY VANADIUM ELECTROLYTE SOLUTIONS, METHODS OF PREPARATION THEREOF AND ALL-VANADIUM REDOX CELLS AND BATTERIES CONTAINING HIGH ENERGY VANADIUM ELECTROLYTE SOLUTIONS UNISEARCH LIMITED (AU) 1998-03-18 EP disclosed
WO-1996035239-A1 HIGH ENERGY DENSITY VANADIUM ELECTROLYTE SOLUTIONS, METHODS OF PREPARATION THEREOF AND ALL-VANADIUM REDOX CELLS AND BATTERIES CONTAINING HIGH ENERGY VANADIUM ELECTROLYTE SOLUTIONS UNISEARCH LIMITED (AU) 1996-11-07 WO disclosed