SCHEMBL9844595

SCHEMBL9844595

O=C([N]CCO)C(O)CO

nearest known ligand 0.42

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
OR51E2 Q9H255 1/20 0.42

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
SCHEMBL9844598 0.75
SCHEMBL1118789 0.64
SCHEMBL9307587 0.62 OR51E2 (0.59) OR51E2
SCHEMBL9333820 0.62 OR51E2 (0.59) OR51E2
SCHEMBL14564211 0.62 OR51E2 (0.59) OR51E2
SCHEMBL1563041 0.61
Ethylene Glycol SCHEMBL28437759 0.61 OR51E2 (0.88) OR51E2
SCHEMBL9736327 0.61
SCHEMBL1765577 0.60 OR51E2 (1.00) OR51E2
Water SCHEMBL21753470 0.60

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-5066823-A Rearrangement reaction, contrast agent for radiology BRACCO INDUSTRIA CHEMICA S.P.A. (IT) 1991-11-19 US disclosed