SCHEMBL12656737

SCHEMBL12656737

CCO[C@H]1OC2COC(C)(C)O[C@H]2C2OC(C)(C)OC21

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 2/20 0.37
▸ CA2 P00918 2/20 0.37
▸ CA9 Q16790 2/20 0.37
▸ CA12 O43570 1/20 0.31
▸ CA4 P22748 1/20 0.31
▸ CA6 P23280 1/20 0.31
▸ CA5A P35218 1/20 0.31
▸ CA7 P43166 1/20 0.31
▸ CA13 Q8N1Q1 1/20 0.31
▸ CA14 Q9ULX7 1/20 0.31
▸ CA5B Q9Y2D0 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
SCHEMBL15892310 0.85 CA2 (0.34) CA1CA2CA9
SCHEMBL18457371 0.82 CA1 (0.40) CA1CA2CA9CA12CA4
SCHEMBL7149970 0.82 CA1 (0.40) CA1CA2CA9CA12CA4
SCHEMBL15512332 0.78 CA1 (0.32) CA1CA2CA9
SCHEMBL18942777 0.78 CA1 (0.32) CA1CA2CA9
SCHEMBL15890505 0.78 L3MBTL1 (0.40) CA1CA2CA9
SCHEMBL13592471 0.78 CA1 (0.32) CA1CA2CA9
SCHEMBL9779964 0.76 CA1 (0.41) CA1CA2CA9CA12CA4
SCHEMBL12560770 0.74 MAPK1 (0.40) CA1CA2
SCHEMBL14440183 0.74 MEN1 (0.37) CA1CA2CA9

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
WO-2011061379-A1 POLYHEDRAL OLIGOMER SILSESQUIOXANES CONTAINING AZIDE OR AZOLE GROUPS, METHOD FOR OBTAINING SAME AND USES THEREOF CONSEJO SUPERIOR DE INVESTIGACIONES CIENTÍFICAS (CSIC) (ES) 2011-05-26 — — WO disclosed
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