SCHEMBL20004822

SCHEMBL20004822

CSN1CCC(COc2ccc3c(c2)C(C)(C)c2[nH]c4cc(Br)ccc4c2C3=O)CC1

nearest known ligand 0.80

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 20/20 0.80

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
SCHEMBL20004817 0.93 ALK (0.81) ALK
SCHEMBL20004302 0.91 ALK (0.77) ALK
SCHEMBL897752 0.89 ALK (1.00) ALK
SCHEMBL897412 0.89 ALK (0.85) ALK
SCHEMBL20004778 0.88 ALK (0.73) ALK
SCHEMBL7809073 0.88 ALK (0.77) ALK
SCHEMBL898081 0.88 ALK (0.80) ALK
Hydrochloric Acid SCHEMBL898014 0.87 ALK (0.76) ALK
Hydrochloric Acid SCHEMBL29963168 0.87 ALK (0.76) ALK
SCHEMBL17448470 0.87 ALK (0.84) 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