SCHEMBL6920159

SCHEMBL6920159

CO[C@H]1O[C@H](CN)[C@@H]2OC(C)(C)O[C@H]12

nearest known ligand 0.43

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.36
CA1 P00915 1/20 0.36
CA9 Q16790 1/20 0.36

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
SCHEMBL10118086 1.00 CA2 (0.36) CA2CA1CA9
SCHEMBL24645804 1.00 CA2 (0.36) CA2CA1CA9
SCHEMBL10135572 1.00 CA2 (0.36) CA2CA1CA9
SCHEMBL7301263 1.00 CA2 (0.36) CA2CA1CA9
SCHEMBL18517496 0.86 G6PD (0.35) CA2CA1CA9
SCHEMBL18805837 0.86 G6PD (0.35) CA2CA1CA9
SCHEMBL8322168 0.83 CA2 (0.34) CA2CA1CA9
SCHEMBL17170416 0.83 CA2 (0.34) CA2CA1CA9
SCHEMBL21449039 0.83 CA2 (0.34) CA2CA1CA9
SCHEMBL2621335 0.83 CA2 (0.34) CA2CA1CA9

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1144425-B1 DERIVATIVES OF MONOSACCHARIDES AS CELL ADHESION INHIBITORS RANBAXY LAB LTD (IN) 2004-06-16 EP disclosed
US-6329344-B1 UREA DERIVATIVE OF ALKYLENE DIOXYFURAN ETHERS RANBAXY LABORATORIES LIMITED (IN) 2001-12-11 US disclosed