SCHEMBL1755830

SCHEMBL1755830

CC1(C)c2cc(OC3CCNCC3)ccc2C(=O)c2c1[nH]c1cc(N)c(F)cc21

nearest known ligand 0.76

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 20/20 0.76

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
SCHEMBL7802565 0.87 ALK (0.67) ALK
SCHEMBL897878 0.87 ALK (0.67) ALK
SCHEMBL898224 0.86 ALK (1.00) ALK
SCHEMBL7811472 0.84 ALK (0.56) ALK
SCHEMBL7809297 0.83 ALK (0.71) ALK
SCHEMBL898160 0.82 ALK (0.75) ALK
SCHEMBL897303 0.80 ALK (0.80) ALK
SCHEMBL897595 0.79 ALK (0.62) ALK
SCHEMBL7811147 0.78 ALK (0.46) ALK
SCHEMBL1755880 0.76 ALK (0.70) 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