SCHEMBL6175573

SCHEMBL6175573

CC(C)c1cc(CC2(C)NC(=O)N(c3ccc(OC(F)(F)F)cc3)C2=O)ccn1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ITGAL P20701 1/20 0.39
AR P10275 5/20 0.38
POLB P06746 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
MMP2 P08253 5/20 0.36
MMP9 P14780 5/20 0.36
MMP1 P03956 4/20 0.36
MMP3 P08254 2/20 0.36
IGF1R P08069 2/20 0.34
NTRK1 P04629 1/20 0.34
PLA2G10 O15496 1/20 0.33
PLA2G2A P14555 1/20 0.33
PLA2G5 P39877 1/20 0.33
PDE2A O00408 1/20 0.33
CYP3A4 P08684 1/20 0.33
GAA P10253 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33

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
SCHEMBL6175657 0.86 IGF1R (0.45) ITGALARPOLBL3MBTL1IGF1R
SCHEMBL6176754 0.86 ITGAL (0.44) ITGALARPOLBL3MBTL1MMP2
SCHEMBL6173435 0.86 IGF1R (0.45) ITGALARPOLBL3MBTL1IGF1R
SCHEMBL6171047 0.85 IGF1R (0.48) ITGALARPOLBL3MBTL1IGF1R
SCHEMBL6172079 0.85 IGF1R (0.47) ITGALARPOLBL3MBTL1IGF1R
SCHEMBL6175755 0.84 ITGAL (0.38) ITGALARPOLBL3MBTL1MMP2
SCHEMBL6175004 0.84 IGF1R (0.42) ITGALARIGF1RCYP3A4CYP2C9
SCHEMBL6177034 0.84 IGF1R (0.40) ITGALARPOLBL3MBTL1IGF1R
SCHEMBL6174845 0.83 NTRK1 (0.38) ITGALARPOLBL3MBTL1MMP2
SCHEMBL6171611 0.83 IGF1R (0.38) ITGALARPOLBL3MBTL1MMP2

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