SCHEMBL20004323

SCHEMBL20004323

CC1(C)c2[nH]c3cc(Br)ccc3c2C(=O)c2cc(Br)c(OCCCO)c(Br)c21

nearest known ligand 0.51

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 20/20 0.51

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
SCHEMBL20004836 0.88 ALK (0.47) ALK
SCHEMBL897933 0.86 ALK (0.56) ALK
SCHEMBL897932 0.86 ALK (0.56) ALK
SCHEMBL897934 0.86 ALK (0.56) ALK
SCHEMBL20356892 0.84 ALK (0.51) ALK
SCHEMBL898089 0.80 ALK (0.50) ALK
SCHEMBL898095 0.79 ALK (0.47) ALK
SCHEMBL898094 0.79 ALK (0.47) ALK
SCHEMBL20004358 0.78 ALK (0.75) ALK
SCHEMBL18255528 0.74 ALK (0.61) 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