SCHEMBL7709793

SCHEMBL7709793

CO[C@@H]1OC(C)C(F)(F)C(OC(C)=O)C1OC(C)=O

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
OGA O60502 1/20 0.31
F10 P00742 1/20 0.31
CA9 Q16790 3/20 0.31
CA12 O43570 2/20 0.31
CA1 P00915 2/20 0.31
CA2 P00918 2/20 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
SCHEMBL20225551 0.73 CA9 (0.33) CA9CA12CA1CA2
SCHEMBL20225550 0.73 CA9 (0.33) CA9CA12CA1CA2
SCHEMBL20229512 0.71 CA9 (0.38) CA9CA12CA1CA2
SCHEMBL1131164 0.71 CA9 (0.38) CA9CA12CA1CA2
SCHEMBL1130045 0.71 CA9 (0.38) CA9CA12CA1CA2
SCHEMBL2614794 0.71 CA9 (0.38) CA9CA12CA1CA2
SCHEMBL2102571 0.71 CA9 (0.38) CA9CA12CA1CA2
SCHEMBL3244545 0.71 CA9 (0.46) OGAF10CA9CA12CA1
SCHEMBL3238675 0.71 CA9 (0.46) OGAF10CA9CA12CA1
SCHEMBL7215110 0.71 CA9 (0.46) OGAF10CA9CA12CA1

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-6355784-B1 TETRACYCLINES AS ANTIINFLAMMATORY AGENTS HOUSTON PHARMACEUTICALS, INC. 2002-03-12 US disclosed