SCHEMBL29940684

SCHEMBL29940684

CC(C)(C)OC(=O)N1CCN(c2cc3c(cc2Cl)C(=O)c2c([nH]c4cc(Br)ccc24)C3(C)C)CC1

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 20/20 0.59
SRPK2 P78362 1/20 0.44
SRPK1 Q96SB4 1/20 0.44
EML4 Q9HC35 1/20 0.44

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
SCHEMBL27087519 1.00 ALK (0.59) ALKSRPK2SRPK1EML4
SCHEMBL27087601 0.89 ALK (0.59) ALKSRPK2SRPK1EML4
SCHEMBL29940520 0.89 ALK (0.59) ALKSRPK2SRPK1EML4
SCHEMBL30009653 0.89 ALK (0.53) ALKSRPK2SRPK1EML4
SCHEMBL27087545 0.88 ALK (0.57) ALKSRPK2SRPK1EML4
SCHEMBL29940676 0.88 ALK (0.57) ALKSRPK2SRPK1EML4
SCHEMBL27087571 0.85 ALK (0.55) ALKSRPK2SRPK1EML4
SCHEMBL27087618 0.85 ALK (0.64) ALKSRPK2SRPK1EML4
SCHEMBL7800549 0.84 ALK (0.55) ALKSRPK2SRPK1EML4
SCHEMBL30009163 0.83 ALK (0.60) ALKSRPK2SRPK1EML4

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
CN-115340523-B Compound with ALK inhibitory activity and preparation method and application thereof 盛世泰科生物医药技术(苏州)股份有限公司 2023-12-15 CN disclosed
CN-115340523-A Compound with ALK inhibitory activity and preparation method and application thereof 盛世泰科生物医药技术(苏州)有限公司 2022-11-15 CN disclosed