SCHEMBL4351950

SCHEMBL4351950

O=[N+]([O-])C1CCCC1CO

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL12803169 0.79 ALDH1A1 (0.30) TDP1
SCHEMBL19490661 0.79 ALDH1A1 (0.30) TDP1
SCHEMBL18208066 0.75
SCHEMBL18215626 0.75
Nitric Acid SCHEMBL8957397 0.75 CA5A (0.40) TDP1
SCHEMBL18208065 0.75
Nitric Acid SCHEMBL8957432 0.75 CA5A (0.40) TDP1
SCHEMBL9909858 0.74
SCHEMBL13816585 0.74 ALDH1A1 (0.31)
SCHEMBL11837321 0.74

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
US-20090285919-A1 Rice Bran Extracts for Inflammation and Methods of Use Thereof HALPERN, BARUCH 2009-11-19 US disclosed