SCHEMBL21443250

SCHEMBL21443250

COc1ccc2c(c1)C(C)(C)c1oc3cc(OS(=O)C(F)(F)F)ccc3c1C2=O

nearest known ligand 0.60

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 20/20 0.60

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
SCHEMBL20004204 0.84 ALK (0.62) ALK
SCHEMBL897054 0.84 ALK (0.62) ALK
SCHEMBL897786 0.82 ALK (0.69) ALK
SCHEMBL21443196 0.80 ALK (0.64) ALK
SCHEMBL898629 0.80 ALK (0.69) ALK
SCHEMBL29963198 0.80 ALK (0.69) ALK
SCHEMBL20366745 0.79 ALK (0.67) ALK
SCHEMBL897628 0.76 ALK (0.86) ALK
SCHEMBL20004533 0.76 ALK (0.86) ALK
SCHEMBL20366540 0.76 ALK (0.86) 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-3345903-B1 TETRACYCLIC COMPOUNDS CHUGAI PHARMACEUTICAL CO LTD (JP) 2019-10-09 EP disclosed