SCHEMBL1755787

SCHEMBL1755787

CCc1cc2c(cc1OC)C(C)(C)c1[nH]c3ccccc3c1C2=O

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 17/20 0.55
EML4 Q9HC35 6/20 0.48
SRPK1 Q96SB4 9/20 0.48
SRPK2 P78362 7/20 0.48
DYRK3 O43781 1/20 0.46
CLK1 P49759 1/20 0.46
CLK2 P49760 1/20 0.46
DYRK1A Q13627 1/20 0.46
DYRK2 Q92630 1/20 0.46
CLK4 Q9HAZ1 1/20 0.46
SRPK3 Q9UPE1 1/20 0.46
DYRK1B Q9Y463 1/20 0.46
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
SCHEMBL27087579 0.86 ALK (0.64) ALKEML4SRPK1SRPK2
SCHEMBL7811871 0.86 ALK (0.57) ALKEML4SRPK1SRPK2DYRK3
SCHEMBL19988194 0.84 SRPK1 (0.49) ALKEML4SRPK1SRPK2DYRK3
SCHEMBL897390 0.83 ALK (0.77) ALKEML4SRPK1SRPK2DYRK3
SCHEMBL18252767 0.79 ALK (0.52) ALKEML4SRPK1SRPK2DYRK3
SCHEMBL29962607 0.79 ALK (0.56) ALK
SCHEMBL897599 0.79 ALK (0.56) ALK
SCHEMBL898181 0.79 ALK (0.57) ALK
SCHEMBL29962794 0.79 ALK (0.57) ALK
SCHEMBL898212 0.78 ALK (0.48) ALKEML4SRPK1SRPK2

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
EP-2441753-A1 TETRACYCLIC COMPOUND Chugai Seiyaku Kabushiki Kaisha (JP) 2012-04-18 EP disclosed