SCHEMBL1755980

SCHEMBL1755980

CC1(C)OC[C@H](COc2ccc3c(c2)C(C)(C)c2[nH]c4c(C(F)(F)F)c(N)ccc4c2C3=O)O1

nearest known ligand 0.51

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 15/20 0.51
MAPK14 Q16539 5/20 0.45

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
SCHEMBL1755844 0.90 ALK (0.55) ALKMAPK14
SCHEMBL897050 0.90 ALK (0.55) ALK
SCHEMBL10283402 0.90 ALK (0.55) ALK
SCHEMBL897052 0.90 ALK (0.55) ALK
SCHEMBL1756002 0.90 ALK (0.53) ALKMAPK14
SCHEMBL1755900 0.89 ALK (0.54) ALKMAPK14
SCHEMBL7813077 0.88 ALK (0.55) ALKMAPK14
SCHEMBL1755960 0.88 ALK (0.55) ALKMAPK14
SCHEMBL7812068 0.86 ALK (0.54) ALKMAPK14
SCHEMBL17636158 0.86 ALK (0.55) 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