SCHEMBL1755893

SCHEMBL1755893

CC1(C)c2cc(OCCCO)c(Br)cc2C(=O)c2c1[nH]c1cccc(Cl)c21

nearest known ligand 0.77

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 20/20 0.77

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
SCHEMBL21766989 0.89 ALK (0.61) ALK
SCHEMBL20366431 0.89 ALK (0.61) ALK
SCHEMBL897514 0.87 ALK (1.00) ALK
SCHEMBL897513 0.87 ALK (1.00) ALK
SCHEMBL10283686 0.87 ALK (0.73) ALK
SCHEMBL897512 0.87 ALK (1.00) ALK
SCHEMBL29962095 0.87 ALK (1.00) ALK
SCHEMBL897126 0.86 ALK (0.72) ALK
SCHEMBL20004128 0.83 ALK (0.61) ALK
SCHEMBL7811110 0.76 ALK (0.58) 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-2975024-B1 TETRACYCLIC COMPOUNDS CHUGAI PHARMACEUTICAL CO LTD (JP) 2018-03-28 EP disclosed
EP-2975024-A1 TETRACYCLIC COMPOUNDS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2016-01-20 EP disclosed
EP-2441753-A1 TETRACYCLIC COMPOUND Chugai Seiyaku Kabushiki Kaisha (JP) 2012-04-18 EP disclosed