SCHEMBL6176592

SCHEMBL6176592

CC(NC(=O)Cc1ccccc1)(c1ccncc1)C1NC(=O)N(c2ccc(S(=O)(=O)C(F)(F)F)cc2)C1=O

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 2/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.34
NAMPT P43490 1/20 0.34
NR2E1 Q9Y466 1/20 0.33
GAA P10253 2/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
RORC P51449 6/20 0.33
SIGMAR1 Q99720 1/20 0.32
CDK8 P49336 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
LMNA P02545 1/20 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
SCHEMBL6174332 0.86 CACNA1H (0.40) ALDH1A1SMN1; SMN2LMNA
SCHEMBL2938437 0.71 IGF1R (0.47) IGF1RPTGDR2NAMPTGAAALDH1A1
SCHEMBL6176591 0.69 IGF1R (0.40) IGF1RNAMPTGAAALDH1A1MAPT
SCHEMBL6176622 0.69 IGF1R (0.40) IGF1RNAMPTGAAALDH1A1SMN1; SMN2
SCHEMBL2937249 0.68 IGF1R (0.47) IGF1RPTGDR2NAMPTGAAALDH1A1
SCHEMBL2940490 0.68 IGF1R (0.61) IGF1RNAMPTGAAALDH1A1MAPT
SCHEMBL2939364 0.67 CNR2 (0.39) IGF1RPTGDR2NAMPTGAAALDH1A1
SCHEMBL6171910 0.66 NAMPT (0.47) NAMPT
SCHEMBL6172506 0.66 NAMPT (0.40) IGF1RNAMPTGAAALDH1A1RORC
SCHEMBL6173243 0.66 METAP2 (0.37) IGF1RNAMPTLMNA

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