SCHEMBL7807963

SCHEMBL7807963

CC1(C)c2ccc(OCCOCCC(=O)O)cc2C(=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
SCHEMBL1755987 0.93 ALK (0.66) ALK
SCHEMBL7805612 0.92 ALK (0.65) ALK
SCHEMBL7808954 0.91 ALK (0.64) ALK
SCHEMBL898319 0.87 ALK (1.00) ALK
SCHEMBL897289 0.81 ALK (0.81) ALK
SCHEMBL7808756 0.80 ALK (0.75) ALK
SCHEMBL7800677 0.80 ALK (0.55) ALK
SCHEMBL896707 0.79 ALK (0.87) ALK
SCHEMBL897622 0.79 ALK (0.85) ALK
SCHEMBL898186 0.78 ALK (0.67) 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
WO-2010143664-A1 TETRACYCLIC COMPOUND 中外製薬株式会社 (JP) 2010-12-16 WO disclosed