SCHEMBL4694476

SCHEMBL4694476

Cc1cccc(Cl)c1CNC(=O)c1cc2[nH]nc(NC(=O)c3ccc(N4CCN(C)CC4)cc3)c2s1

nearest known ligand 0.75

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
AURKA O14965 20/20 0.75

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
Trifluoroacetic Acid SCHEMBL3881545 0.95 AURKA (0.70) AURKA
SCHEMBL3882182 0.89 AURKA (0.79) AURKA
SCHEMBL4692932 0.88 AURKA (0.72) AURKA
SCHEMBL3894750 0.87 AURKA (0.84) AURKA
Hydrochloric Acid SCHEMBL4698082 0.86 AURKA (0.82) AURKA
SCHEMBL3881075 0.86 AURKA (0.85) AURKA
SCHEMBL3885418 0.86 AURKA (1.00) AURKA
SCHEMBL3887141 0.85 AURKA (0.78) AURKA
Hydrochloric Acid SCHEMBL4696619 0.85 AURKA (0.83) AURKA
SCHEMBL4696441 0.84 AURKA (1.00) AURKA

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-1534716-B1 HETEROBICYCLIC PYRAZOLE DERIVATIVES AS KINASE INHIBITORS PFIZER ITALIA SRL (IT) 2008-04-23 EP claimed