SCHEMBL20004227

SCHEMBL20004227

CC(C)(O)OCCCOc1ccc2c(c1)C1(CCOCC1)c1[nH]c3cc(C#N)ccc3c1C2=O

nearest known ligand 0.72

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 20/20 0.72

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
SCHEMBL20004143 0.89 ALK (0.78) ALK
SCHEMBL20004160 0.86 ALK (0.75) ALK
SCHEMBL20004736 0.85 ALK (0.72) ALK
SCHEMBL897150 0.84 ALK (0.92) ALK
SCHEMBL1755916 0.83 ALK (1.00) ALK
SCHEMBL897386 0.83 ALK (0.76) ALK
SCHEMBL897346 0.82 ALK (0.86) ALK
SCHEMBL897347 0.82 ALK (0.86) ALK
SCHEMBL898259 0.81 ALK (0.72) ALK
SCHEMBL20004755 0.81 ALK (0.77) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3613729-A1 TETRACYCLIC COMPOUNDS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2020-02-26 EP disclosed
EP-3345903-B1 TETRACYCLIC COMPOUNDS CHUGAI PHARMACEUTICAL CO LTD (JP) 2019-10-09 EP disclosed
EP-3345903-A1 TETRACYCLIC COMPOUNDS Chugai Seiyaku Kabushiki Kaisha (JP) 2018-07-11 EP disclosed
EP-2975024-B1 TETRACYCLIC COMPOUNDS CHUGAI PHARMACEUTICAL CO LTD (JP) 2018-03-28 EP disclosed