SCHEMBL20004230

SCHEMBL20004230

CCN1CCC(Oc2cc3c(cc2S(=O)(=O)N(C)C)C(=O)c2c([nH]c4cc(NC)ccc24)C3(C)C)CC1

nearest known ligand 0.49

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 20/20 0.49
EML4 Q9HC35 1/20 0.43
KDR P35968 1/20 0.40

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
SCHEMBL10283676 0.90 ALK (0.53) ALKEML4KDR
SCHEMBL7810856 0.88 ALK (0.49) ALKEML4
SCHEMBL897751 0.87 ALK (0.66) ALKEML4KDR
SCHEMBL897242 0.79 ALK (0.76) ALKEML4
SCHEMBL7815455 0.77 ALK (0.52) ALKEML4
SCHEMBL897420 0.76 ALK (0.67) ALKEML4
SCHEMBL24676161 0.75 ALK (0.49) ALKEML4
SCHEMBL20004233 0.74 ALK (0.64) ALKEML4KDR
SCHEMBL20366523 0.73 ALK (0.63) ALKEML4KDR
SCHEMBL20004663 0.71 ALK (0.75) 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