SCHEMBL20004186

SCHEMBL20004186

CNc1ccc2c3c([nH]c2c1)C(C)(C)c1cc(OS(=O)(=O)C(F)(F)F)ccc1C3=O

nearest known ligand 0.54

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 20/20 0.54

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
SCHEMBL30010107 0.85 ALK (0.53) ALK
SCHEMBL24675629 0.83 ALK (0.60) ALK
SCHEMBL896685 0.83 ALK (0.76) ALK
SCHEMBL21982423 0.82 ALK (0.51) ALK
SCHEMBL24675628 0.82 ALK (0.51) ALK
SCHEMBL20366488 0.78 ALK (0.61) ALK
SCHEMBL1756015 0.77 ALK (0.77) ALK
SCHEMBL29962191 0.77 ALK (0.77) ALK
SCHEMBL897204 0.77 ALK (0.51) ALK
SCHEMBL897805 0.77 ALK (0.52) ALK

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-2975024-B1 TETRACYCLIC COMPOUNDS CHUGAI PHARMACEUTICAL CO LTD (JP) 2018-03-28 EP disclosed