SCHEMBL14747657

SCHEMBL14747657

O=C1OCCCCCCCCS1

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.39
CA9 Q16790 1/20 0.39

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
SCHEMBL10295091 1.00 CA1 (0.39) CA1CA9
SCHEMBL15692256 1.00 CA1 (0.39) CA1CA9
SCHEMBL2182753 1.00
SCHEMBL9539417 0.97
SCHEMBL6752723 0.90
SCHEMBL621556 0.78
SCHEMBL2014763 0.78
SCHEMBL28838694 0.70
SCHEMBL29629139 0.70
SCHEMBL11435079 0.70 CA1 (0.39) CA1CA9

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-8389746-B2 Cyclic carbonyl compounds with pendant carbonate groups, preparations thereof, and polymers therefrom INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2013-03-05 US disclosed