SCHEMBL29940408

SCHEMBL29940408

CC1(C)c2cc(OS(=O)(=O)C(F)(F)F)c(C#N)cc2C(=O)c2c1[nH]c1cc(Br)ccc21

nearest known ligand 0.53

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 20/20 0.53

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
SCHEMBL27087583 1.00 ALK (0.53) ALK
SCHEMBL27087556 0.86 ALK (0.56) ALK
SCHEMBL29940536 0.86 ALK (0.56) ALK
SCHEMBL27087535 0.86 ALK (0.67) ALK
SCHEMBL29940496 0.85 ALK (0.53) ALK
SCHEMBL27087513 0.85 ALK (0.53) ALK
SCHEMBL897356 0.84 ALK (0.70) ALK
SCHEMBL897656 0.80 ALK (0.60) ALK
SCHEMBL27087554 0.80 ALK (0.56) ALK
SCHEMBL898305 0.80 SRPK1 (0.65) 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 3 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
WO-2022237813-A1 COMPOUND HAVING ALK INHIBITORY ACTIVITY, PREPARATION METHOD THEREFOR AND USE THEREOF 盛世泰科生物医药技术(苏州)有限公司 2022-11-17 WO 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