SCHEMBL20366648

SCHEMBL20366648

C=NCc1ccc2c3c([nH]c2c1)C(C)(C)c1ccc(OC[C@H]2COC(C)(C)O2)cc1C3=O

nearest known ligand 0.52

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 16/20 0.52
MAPK14 Q16539 4/20 0.40

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
SCHEMBL21443216 0.90 ALK (0.53) ALKMAPK14
SCHEMBL897429 0.87 ALK (0.64) ALK
SCHEMBL897431 0.87 ALK (0.64) ALK
SCHEMBL20004278 0.86 ALK (0.51) ALKMAPK14
SCHEMBL897571 0.85 ALK (0.69) ALK
SCHEMBL897573 0.85 ALK (0.69) ALK
SCHEMBL20004225 0.85 ALK (0.49) ALKMAPK14
SCHEMBL1755860 0.85 ALK (0.52) ALK
SCHEMBL21443138 0.83 ALK (0.43) ALKMAPK14
SCHEMBL24676174 0.81 ALK (0.55) 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 3 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