SCHEMBL20366606

SCHEMBL20366606

CCN(CC)CCOc1ccc2c(c1)C(C)(C)c1[nH]c3cc(C#N)c(F)cc3c1C2

nearest known ligand 0.57

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 19/20 0.57

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
SCHEMBL898199 0.83 ALK (0.81) ALK
SCHEMBL897520 0.83 ALK (0.52) ALK
SCHEMBL897167 0.73 ALK (1.00) ALK
SCHEMBL897432 0.70 ALK (1.00) ALK
SCHEMBL1755880 0.70 ALK (0.70) ALK
SCHEMBL898122 0.70 ALK (0.69) ALK
SCHEMBL898016 0.65 ALK (0.74) ALK
SCHEMBL1756015 0.65 ALK (0.77) ALK
SCHEMBL29962191 0.65 ALK (0.77) ALK
SCHEMBL21443225 0.65 ALK (0.81) 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-A1 TETRACYCLIC COMPOUNDS Chugai Seiyaku Kabushiki Kaisha (JP) 2018-07-11 EP disclosed