SCHEMBL20004482

SCHEMBL20004482

C/N=C\c1ccc2c3c([nH]c2c1)C(C)(C)c1cc(OCCNS(C)(=O)=O)ccc1C3=O

nearest known ligand 0.71

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 20/20 0.71

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
SCHEMBL20366536 0.90 ALK (0.73) ALK
SCHEMBL20004478 0.87 ALK (0.56) ALK
SCHEMBL20004532 0.85 ALK (0.59) ALK
SCHEMBL896536 0.83 ALK (1.00) ALK
SCHEMBL21982423 0.80 ALK (0.51) ALK
SCHEMBL20366495 0.78 ALK (0.56) ALK
SCHEMBL20004119 0.76 ALK (0.65) ALK
SCHEMBL20004556 0.76 ALK (0.66) ALK
SCHEMBL7811243 0.76 ALK (0.70) ALK
SCHEMBL7808541 0.76 ALK (0.59) 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