SCHEMBL20366367

SCHEMBL20366367

Cn1c2c(c3ccc(Br)cc31)Cc1cc(OC[C@H](O)CO)ccc1C2(C)C

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 18/20 0.52
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL896863 0.81 ALK (0.70) ALK
SCHEMBL896858 0.81 ALK (0.70) ALK
SCHEMBL896861 0.81 ALK (0.70) ALK
SCHEMBL898333 0.79 ALK (0.82) ALK
SCHEMBL898330 0.79 ALK (0.82) ALK
SCHEMBL898332 0.79 ALK (0.82) ALK
SCHEMBL21443207 0.72 ALK (0.71) ALK
SCHEMBL20004260 0.72 ALK (0.71) ALK
SCHEMBL1756013 0.71 ALK (0.77) ALK
SCHEMBL20004258 0.70 ALK (0.68) 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 2 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-A1 TETRACYCLIC COMPOUNDS Chugai Seiyaku Kabushiki Kaisha (JP) 2018-07-11 EP disclosed