SCHEMBL6171503

SCHEMBL6171503

C[C@]1(Cc2ccnc3ccccc23)NC(=O)N(c2ccc(S(=O)(=O)C(F)(F)F)cc2)C1=O

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 2/20 0.65
AR P10275 6/20 0.43
KMT2A Q03164 2/20 0.35
HSD11B1 P28845 1/20 0.35
ITGAL P20701 1/20 0.34
LOXL2 Q9Y4K0 1/20 0.34
TSHR P16473 1/20 0.34
TP53 P04637 1/20 0.33
HRH4 Q9H3N8 1/20 0.33
PTGDR2 Q9Y5Y4 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
NAMPT P43490 1/20 0.32

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
SCHEMBL6175292 1.00 IGF1R (0.65) IGF1RARKMT2AHSD11B1ITGAL
Trifluoroacetic Acid SCHEMBL17558459 0.95 IGF1R (0.60) IGF1RARKMT2AHSD11B1ITGAL
Trifluoroacetic Acid SCHEMBL17558350 0.95 IGF1R (0.60) IGF1RARKMT2AHSD11B1ITGAL
SCHEMBL6250335 0.88 IGF1R (0.51) IGF1RARKMT2AITGALTSHR
SCHEMBL6174186 0.88 IGF1R (0.51) IGF1RARKMT2AITGALTSHR
SCHEMBL6172368 0.87 IGF1R (0.52) IGF1RARKMT2AITGALTSHR
SCHEMBL6173676 0.87 IGF1R (0.52) IGF1RARKMT2AITGALTSHR
SCHEMBL6175236 0.87 IGF1R (0.50) IGF1RARKMT2AITGALTSHR
SCHEMBL6173279 0.87 IGF1R (0.50) IGF1RARKMT2AITGALTSHR
SCHEMBL6173786 0.87 IGF1R (0.50) IGF1RAR

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