SCHEMBL13177342

SCHEMBL13177342

Cc1cc(O)ccc1N1C(=O)N(Cc2ccncc2)C(C)(C)C1=O

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 8/20 0.50
TAS2R8 Q9NYW2 4/20 0.46
ESR1 P03372 1/20 0.41
ESR2 Q92731 1/20 0.41
HDAC1 Q13547 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
PPARG P37231 1/20 0.39
PPARD Q03181 1/20 0.39
PPARA Q07869 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
SCHEMBL13177530 0.88 IGF1R (0.50) IGF1RTAS2R8HDAC1HDAC6
SCHEMBL13177341 0.87 IGF1R (0.49) IGF1RTAS2R8HDAC1HDAC6
SCHEMBL2941564 0.81 IGF1R (0.53) IGF1RTAS2R8PPARGPPARDPPARA
SCHEMBL13076385 0.78 IGF1R (0.52) IGF1RTAS2R8PPARGPPARDPPARA
Trifluoroacetic Acid SCHEMBL19410373 0.76 IGF1R (0.52) IGF1RTAS2R8PPARGPPARDPPARA
SCHEMBL13039129 0.74 IGF1R (0.67) IGF1RTAS2R8
SCHEMBL13177453 0.74 IGF1R (0.57) IGF1RTAS2R8
SCHEMBL4882177 0.73 IGF1R (0.56) IGF1RTAS2R8PPARGPPARDPPARA
SCHEMBL4855706 0.72 IGF1R (0.50) IGF1RTAS2R8HDAC1HDAC6
SCHEMBL2935325 0.72 IGF1R (0.53) 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
EP-1599464-B1 NOVEL CYCLIC UREA DERIVATIVES, PREPARATION METHOD THEREOF AND PHARMACEUTICAL USE OF SAME AS KINASE INHIBITORS AVENTIS PHARMA SA (FR) 2010-09-22 EP disclosed