SCHEMBL4861609

SCHEMBL4861609

COc1c(F)c(C)c(N2C(=O)N(Cc3ccncc3)C(C)(C)C2=O)c(F)c1F

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 7/20 0.51
TAS2R8 Q9NYW2 6/20 0.45
HDAC1 Q13547 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
PPARG P37231 1/20 0.38
PPARD Q03181 1/20 0.38
PPARA Q07869 1/20 0.38
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.38
TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL3729601 0.87 IGF1R (0.49) IGF1RTAS2R8HDAC1HDAC6PPARG
SCHEMBL19410409 0.83 IGF1R (0.46) IGF1RTAS2R8HDAC1HDAC6PPARG
SCHEMBL19410365 0.83 IGF1R (0.49) IGF1RTAS2R8HDAC1HDAC6LMNA
SCHEMBL4855706 0.77 IGF1R (0.50) IGF1RTAS2R8HDAC1HDAC6
SCHEMBL19410393 0.72 IGF1R (0.55) IGF1RTAS2R8HDAC1HDAC6
SCHEMBL13039129 0.72 IGF1R (0.67) IGF1RTAS2R8
SCHEMBL2938337 0.72 IGF1R (0.54) IGF1RTAS2R8PPARGPPARDPPARA
SCHEMBL13039186 0.71 IGF1R (0.68) IGF1RTAS2R8
SCHEMBL19410403 0.70 IGF1R (0.44) IGF1RTAS2R8HDAC1HDAC6
SCHEMBL19410404 0.70 IGF1R (0.55) IGF1RTAS2R8

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-7354933-B2 Protein kinase inhibitors; antitumor agents; such as 5-methyl-1-quinol-4-ylmethyl-3-(4-trifluoromethanesulfonylphenyl)imidazolidine-2,4-dione trifluoroacetate AVENTIS PHARMA SA (FR) 2008-04-08 US disclosed