SCHEMBL7800549

SCHEMBL7800549

CC(C)(C)OC(=O)N1CCN(c2cc3c(cc2Br)C(=O)c2c([nH]c4cc(N)ccc24)C3(C)C)CC1

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 20/20 0.55
SRPK2 P78362 1/20 0.44
SRPK1 Q96SB4 1/20 0.44
EML4 Q9HC35 1/20 0.44
KDR P35968 1/20 0.42

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
SCHEMBL7809489 0.88 ALK (0.56) ALKSRPK2SRPK1EML4KDR
SCHEMBL897868 0.88 ALK (0.69) ALKSRPK2SRPK1EML4KDR
SCHEMBL1755929 0.87 ALK (0.59) ALKKDR
SCHEMBL27087519 0.84 ALK (0.59) ALKSRPK2SRPK1EML4
SCHEMBL29940684 0.84 ALK (0.59) ALKSRPK2SRPK1EML4
SCHEMBL1755967 0.83 ALK (0.64) ALKSRPK2SRPK1EML4KDR
SCHEMBL7807485 0.83 ALK (0.62) ALK
SCHEMBL29940520 0.83 ALK (0.59) ALKSRPK2SRPK1EML4KDR
SCHEMBL27087601 0.83 ALK (0.59) ALKSRPK2SRPK1EML4KDR
SCHEMBL1755874 0.83 ALK (0.59) ALKSRPK2SRPK1EML4KDR

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