SCHEMBL6172228

SCHEMBL6172228

CN1CCC(c2cnccc2C(NC=O)N2CC(=O)N(c3ccc(SC(F)(F)F)cc3)C2=O)CC1

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 10/20 0.35
CYP17A1 P05093 3/20 0.31

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
SCHEMBL6173460 0.88 HTR2A (0.34)
SCHEMBL6173034 0.81 IGF1R (0.38) IGF1R
SCHEMBL6173685 0.73 HTR6 (0.33) IGF1R
SCHEMBL6171670 0.73 IGF1R (0.38) IGF1R
SCHEMBL2938168 0.69 IGF1R (0.40) IGF1R
SCHEMBL6175147 0.69 HTR2A (0.34)
SCHEMBL6174365 0.68 HTR6 (0.35)
SCHEMBL6175215 0.68 CTSS (0.34) IGF1R
SCHEMBL2931697 0.66 IGF1R (0.40) IGF1RCYP17A1
SCHEMBL6173952 0.66 IGF1R (0.37) IGF1R

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1599464-A2 NOVEL CYCLIC UREA DERIVATIVES, PREPARATION METHOD THEREOF AND PHARMACEUTICAL USE OF SAME AS KINASE INHIBITORS Aventis Pharma S.A. (FR) 2005-11-30 EP disclosed
WO-2004070050-A2 CYCLIC UREA DERIVATIVES, PREPARATION METHOD THEREOF AND PHARMACEUTICAL USE OF SAME AS KINASE INHIBITORS AVENTIS PHARMA S.A. (FR) 2004-08-19 WO disclosed