SCHEMBL20004664

SCHEMBL20004664

CCN(CC)CC[S+]([O-])c1cc2c(cc1OC)C(C)(C)c1[nH]c3cc(C#N)ccc3c1C2=O

nearest known ligand 0.70

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 17/20 0.70
SRPK1 Q96SB4 6/20 0.53
SRPK2 P78362 4/20 0.51
EML4 Q9HC35 3/20 0.51
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
SCHEMBL20004130 0.83 ALK (0.73) ALKSRPK1SRPK2EML4
SCHEMBL20366485 0.82 ALK (0.69) ALKSRPK1SRPK2EML4
SCHEMBL897610 0.82 ALK (0.72) ALKSRPK1SRPK2EML4
SCHEMBL897203 0.82 ALK (1.00) ALKSRPK1SRPK2EML4DYRK3
SCHEMBL897390 0.80 ALK (0.77) ALKSRPK1SRPK2EML4DYRK3
SCHEMBL20004101 0.80 ALK (0.64) ALKSRPK1SRPK2EML4
SCHEMBL897528 0.78 ALK (0.92) ALKSRPK1SRPK2EML4
SCHEMBL10283126 0.78 ALK (0.78) ALKSRPK1SRPK2EML4
SCHEMBL897185 0.78 ALK (0.79) ALKSRPK1SRPK2EML4
SCHEMBL16775671 0.78 ALK (0.78) ALKSRPK1SRPK2EML4

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-3345903-B1 TETRACYCLIC COMPOUNDS CHUGAI PHARMACEUTICAL CO LTD (JP) 2019-10-09 EP disclosed
EP-2975024-B1 TETRACYCLIC COMPOUNDS CHUGAI PHARMACEUTICAL CO LTD (JP) 2018-03-28 EP disclosed