SCHEMBL1755854

SCHEMBL1755854

CC(C)(C)OC(=O)NCCNC(=O)c1ccc2c(c1)C(C)(C)c1[nH]c3cc(N)ccc3c1C2=O

nearest known ligand 0.59

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 20/20 0.59

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
SCHEMBL1755776 0.91 ALK (0.59) ALK
SCHEMBL7809858 0.90 ALK (0.58) ALK
SCHEMBL10283384 0.88 ALK (0.74) ALK
SCHEMBL7811569 0.87 ALK (0.64) ALK
SCHEMBL7812176 0.86 ALK (0.63) ALK
SCHEMBL7814493 0.85 ALK (0.79) ALK
SCHEMBL7811452 0.85 ALK (0.78) ALK
SCHEMBL7812903 0.81 ALK (0.59) ALK
SCHEMBL10283102 0.80 ALK (0.74) ALK
SCHEMBL21443160 0.80 ALK (0.68) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2441753-A1 TETRACYCLIC COMPOUND Chugai Seiyaku Kabushiki Kaisha (JP) 2012-04-18 EP disclosed
WO-2010143664-A1 TETRACYCLIC COMPOUND 中外製薬株式会社 (JP) 2010-12-16 WO disclosed