SCHEMBL20004180

SCHEMBL20004180

CC1(C)c2cc(OCCCO)ccc2C(=O)c2c1[nH]c1c(C(N)=O)c(C#N)ccc21

nearest known ligand 0.78

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 20/20 0.78

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
SCHEMBL20004178 0.92 ALK (0.78) ALK
SCHEMBL20004169 0.90 ALK (0.70) ALK
SCHEMBL20004788 0.88 ALK (0.64) ALK
SCHEMBL20004137 0.88 ALK (0.64) ALK
SCHEMBL20004872 0.88 ALK (0.77) ALK
SCHEMBL897682 0.88 ALK (1.00) ALK
SCHEMBL897686 0.88 ALK (1.00) ALK
SCHEMBL897684 0.88 ALK (1.00) ALK
SCHEMBL20004825 0.87 ALK (0.65) ALK
SCHEMBL20004805 0.87 ALK (0.63) 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