SCHEMBL20004350

SCHEMBL20004350

CC(C)(O)O[C@@H](CCO[Si](C)(C)C(C)(C)C)COc1ccc2c(c1)C(C)(C)c1[nH]c3cc(I)ccc3c1C2=O

nearest known ligand 0.60

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 20/20 0.60

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
SCHEMBL20004289 0.79 ALK (0.65) ALK
SCHEMBL20366660 0.79 ALK (0.65) ALK
SCHEMBL20366645 0.79 ALK (0.63) ALK
SCHEMBL20004849 0.79 ALK (0.63) ALK
SCHEMBL897839 0.78 ALK (0.64) ALK
SCHEMBL897841 0.78 ALK (0.64) ALK
SCHEMBL897838 0.78 ALK (0.64) ALK
SCHEMBL20366451 0.77 ALK (0.50) ALK
SCHEMBL21443291 0.76 ALK (0.61) ALK
SCHEMBL898368 0.76 ALK (1.00) 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 1 patent. 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