SCHEMBL5690786

SCHEMBL5690786

OCC#CCOCC(O)CO

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.39
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
CHRNA7 P36544 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
SCHEMBL5691869 0.93 USP2 (0.43) USP2ALDH1A1LMNACHRNA7
SCHEMBL5690805 0.84 USP2 (0.41) USP2ALDH1A1LMNACHRNA7
SCHEMBL29224171 0.81
SCHEMBL23068710 0.81 USP2 (0.44) USP2
SCHEMBL10568086 0.80 USP2 (0.38) USP2ALDH1A1LMNACHRNA7
SCHEMBL9737895 0.80 USP2 (0.42) USP2ALDH1A1LMNACHRNA7
SCHEMBL29707083 0.77 HSD17B10 (0.43)
SCHEMBL368683 0.76
SCHEMBL28984717 0.74
SCHEMBL4592237 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1084712-B1 X-ray contrast agents AMERSHAM HEALTH AS (NO) 2006-03-22 EP disclosed
US-6406680-B1 IODINE CONTAINING OLEFINS AS CONTRAST AGENTS NYCOMED IMAGING AS (NO) 2002-06-18 US disclosed
EP-1084712-A2 X-ray contrast agents NYCOMED IMAGING AS (NO) 2001-03-21 EP disclosed
US-4460714-A CONTAINING ISOCYANATE, PEROXIDE CURING AGENT, SURFACTANTS AND ACCELERATOR PENNWALT CORPORATION (US) 1984-07-17 US disclosed