SCHEMBL19903211

SCHEMBL19903211

CCC[C@H](C)OS(=O)(=O)C(F)(F)F

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA7 P43166 1/20 0.31
CA14 Q9ULX7 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL6967239 1.00 CA12 (0.31) CA12CA1CA2CA7CA14
SCHEMBL29308549 1.00 CA12 (0.31) CA12CA1CA2CA7CA14
SCHEMBL14779869 0.89 CA1 (0.30) CA1CA2
SCHEMBL10359016 0.86 TP53 (0.40)
SCHEMBL14779142 0.85
SCHEMBL14779256 0.85
SCHEMBL3641633 0.85 EPHX1 (0.41)
SCHEMBL14778715 0.83
SCHEMBL14779657 0.83
SCHEMBL14139030 0.83

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
EP-3287464-A1 ONE POT SYNTHESIS OF TETRAZOLE DERIVATIVES OF SIROLIMUS Abbott Laboratories (US) 2018-02-28 EP disclosed