SCHEMBL20004563

SCHEMBL20004563

CCN(CC)CCOc1ccc2c(c1)C(C)(C)c1[nH]c3cc(/C=N\C)c(Br)cc3c1C2=O

nearest known ligand 0.71

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 20/20 0.71

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
SCHEMBL7800172 0.85 ALK (0.77) ALK
SCHEMBL897167 0.83 ALK (1.00) ALK
SCHEMBL7811467 0.83 ALK (1.00) ALK
SCHEMBL20004152 0.82 ALK (0.61) ALK
SCHEMBL20366644 0.82 ALK (0.61) ALK
SCHEMBL898504 0.81 ALK (1.00) ALK
SCHEMBL21443225 0.80 ALK (0.81) ALK
SCHEMBL898277 0.80 ALK (0.78) ALK
SCHEMBL29962453 0.80 ALK (0.78) ALK
SCHEMBL29962660 0.79 ALK (0.80) 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