SCHEMBL1755849

SCHEMBL1755849

CC1(C)c2cc(OC[C@@H](O)[C@H](O)CO)ccc2C(=O)c2c1[nH]c1cc(N)ccc21

nearest known ligand 0.81

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 20/20 0.81

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
SCHEMBL7817678 0.93 ALK (0.70) ALK
SCHEMBL20004321 0.91 ALK (0.81) ALK
SCHEMBL21443325 0.90 ALK (0.77) ALK
SCHEMBL1755958 0.90 ALK (0.80) ALK
SCHEMBL898254 0.90 ALK (0.80) ALK
SCHEMBL898368 0.90 ALK (1.00) ALK
SCHEMBL1703737 0.90 ALK (0.80) ALK
SCHEMBL898583 0.90 ALK (0.86) ALK
SCHEMBL1703517 0.89 ALK (0.85) ALK
SCHEMBL20356897 0.89 ALK (0.85) 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