SCHEMBL30009797

SCHEMBL30009797

C#Cc1ccc2c3c([nH]c2c1)C(C)(C)c1ccc(CC)cc1C3=O

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 17/20 0.54
SRPK1 Q96SB4 9/20 0.53
SRPK2 P78362 7/20 0.53
EML4 Q9HC35 6/20 0.52
DYRK3 O43781 1/20 0.51
CLK1 P49759 1/20 0.51
CLK2 P49760 1/20 0.51
DYRK1A Q13627 1/20 0.51
DYRK2 Q92630 1/20 0.51
CLK4 Q9HAZ1 1/20 0.51
SRPK3 Q9UPE1 1/20 0.51
DYRK1B Q9Y463 1/20 0.51

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
SCHEMBL897598 0.89 SRPK1 (0.66) ALKSRPK1SRPK2EML4DYRK3
SCHEMBL29528746 0.89 SRPK1 (0.66) ALKSRPK1SRPK2EML4DYRK3
SCHEMBL29940400 0.85 ALK (0.54) ALKSRPK1SRPK2EML4DYRK3
SCHEMBL897781 0.84 ALK (0.71) ALKSRPK1SRPK2
SCHEMBL20004194 0.84 SRPK1 (0.60) ALKSRPK1SRPK2EML4DYRK3
SCHEMBL1755889 0.83 ALK (0.49) ALKSRPK1SRPK2EML4DYRK3
SCHEMBL1755815 0.82 ALK (0.54) ALKSRPK1SRPK2
SCHEMBL18252767 0.82 ALK (0.52) ALKSRPK1SRPK2EML4DYRK3
SCHEMBL22215253 0.79 SRPK1 (0.70) ALKSRPK1SRPK2EML4DYRK3
SCHEMBL30713726 0.78 ALK (0.54) ALKSRPK1SRPK2EML4DYRK3

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-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