SCHEMBL1755846

SCHEMBL1755846

CC1(C)c2cc(C(=O)N3CCN(C(C)(C)C)CC3)ccc2C(=O)c2c1[nH]c1cc(N)ccc21

nearest known ligand 0.77

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 20/20 0.77

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
SCHEMBL7807485 0.89 ALK (0.62) ALK
SCHEMBL1755814 0.88 ALK (0.64) ALK
SCHEMBL7809047 0.88 ALK (0.77) ALK
SCHEMBL896934 0.87 ALK (1.00) ALK
SCHEMBL7800294 0.86 ALK (0.78) ALK
SCHEMBL1755951 0.84 ALK (0.65) ALK
SCHEMBL7805101 0.81 ALK (0.72) ALK
SCHEMBL16775669 0.77 ALK (0.83) ALK
SCHEMBL1755929 0.77 ALK (0.59) ALK
SCHEMBL897299 0.76 ALK (0.81) 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