SCHEMBL13989255

SCHEMBL13989255

CC(Oc1csc(-n2cnc3cc(N)ccc32)c1)c1ccccc1Cl

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 15/20 0.51
PLK3 Q9H4B4 9/20 0.51
CYP2C9 P11712 5/20 0.51
IKBKE Q14164 2/20 0.48
CDK2 P24941 1/20 0.48
CYP3A4 P08684 7/20 0.46
PIK3CD O00329 1/20 0.43
NUAK1 O60285 1/20 0.43
PDGFRB P09619 1/20 0.43
PIM1 P11309 1/20 0.43
KDR P35968 1/20 0.43
NEK2 P51955 1/20 0.43
FGFR1 P11362 1/20 0.43

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
SCHEMBL14047822 0.86 PLK1 (0.50) PLK1PLK3CYP2C9IKBKECDK2
SCHEMBL14047659 0.85 PLK1 (0.56) PLK1PLK3CYP2C9IKBKECDK2
SCHEMBL13462810 0.84 IKBKE (0.49) PLK1PLK3CYP2C9IKBKECDK2
SCHEMBL14047658 0.83 PLK1 (0.55) PLK1PLK3CYP2C9IKBKECDK2
SCHEMBL14047896 0.82 PLK1 (0.51) PLK1PLK3CYP2C9IKBKECDK2
SCHEMBL14047895 0.82 PLK1 (0.67) PLK1PLK3CYP2C9IKBKECDK2
SCHEMBL13632297 0.81 PLK1 (0.49) PLK1PLK3CYP2C9IKBKECDK2
SCHEMBL13632188 0.81 PLK1 (0.48) PLK1PLK3CYP2C9IKBKECDK2
SCHEMBL14047802 0.79 PLK1 (0.54) PLK1PLK3CYP2C9IKBKECDK2
SCHEMBL14047661 0.78 PLK1 (0.56) PLK1PLK3CYP2C9IKBKECDK2

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
US-7465807-B2 Process for preparing benzimidazole thiophenes SMITHKLINE BEECHAM CORPORATION (US) 2008-12-16 US disclosed