SCHEMBL20004321

SCHEMBL20004321

Cc1ccc2c3c([nH]c2c1)C(C)(C)c1cc(OCC(O)C(O)CO)ccc1C3=O

nearest known ligand 0.81

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 20/20 0.81

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
SCHEMBL20004920 0.93 ALK (0.77) ALK
SCHEMBL898783 0.93 ALK (0.77) ALK
SCHEMBL1755849 0.91 ALK (0.81) ALK
SCHEMBL1755958 0.90 ALK (0.80) ALK
SCHEMBL898583 0.90 ALK (0.86) ALK
SCHEMBL898254 0.90 ALK (0.80) ALK
SCHEMBL1703737 0.90 ALK (0.80) ALK
SCHEMBL898368 0.90 ALK (1.00) ALK
SCHEMBL20366620 0.90 ALK (0.67) ALK
SCHEMBL20004806 0.90 ALK (0.67) 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