SCHEMBL29487455

SCHEMBL29487455

Cc1cc(Nc2nc(Sc3ccc(N)cc3)nc(N(C)C(C)C)c2C)n[nH]1

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
AURKA O14965 17/20 0.50
AURKB Q96GD4 15/20 0.50
GSK3B P49841 12/20 0.50
SRC P12931 8/20 0.50
AURKC Q9UQB9 2/20 0.44
JAK2 O60674 1/20 0.39
JAK3 P52333 1/20 0.39

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
SCHEMBL18166041 1.00 AURKA (0.50) AURKAAURKBGSK3BSRCAURKC
SCHEMBL29487425 0.93 AURKA (0.51) AURKAAURKBGSK3BSRCAURKC
SCHEMBL19998181 0.93 AURKA (0.51) AURKAAURKBGSK3BSRCAURKC
SCHEMBL29487420 0.91 AURKA (0.62) AURKAAURKBGSK3BSRCAURKC
SCHEMBL18166026 0.91 AURKA (0.62) AURKAAURKBGSK3BSRCAURKC
SCHEMBL18165842 0.86 AURKB (0.64) AURKAAURKBGSK3BSRCAURKC
SCHEMBL18166051 0.84 AURKB (0.53) AURKAAURKBGSK3BSRCAURKC
SCHEMBL18166024 0.84 AURKA (0.41) AURKAAURKBGSK3BSRCJAK2
SCHEMBL29487448 0.84 AURKA (0.41) AURKAAURKBGSK3BSRCJAK2
SCHEMBL18154742 0.82 AURKB (0.66) AURKAAURKBGSK3BSRCAURKC

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-3283482-B1 PLK4 INHIBITORS LUDWIG INST FOR CANCER RES LTD (CH) 2022-04-06 EP disclosed