SCHEMBL6171386

SCHEMBL6171386

CC(c1ccncc1C1CCCCC1)C1NC(=O)N(c2ccc(OC(F)(F)F)cc2)C1=O

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
LIPE Q05469 7/20 0.34
GABRA1 P14867 1/20 0.33
GABRG2 P18507 1/20 0.33
GABRB3 P28472 1/20 0.33
GABRA3 P34903 1/20 0.33
PDE9A O76083 1/20 0.33
CXCR3 P49682 1/20 0.32
CHRM4 P08173 1/20 0.31
GCGR P47871 2/20 0.31
NPBWR1 P48145 1/20 0.31
MCHR1 Q99705 1/20 0.31
PIK3CA P42336 1/20 0.31
PRKDC P78527 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
SCHEMBL6175770 0.85 PTGS1 (0.39) LMNAPOLBL3MBTL1LIPE
SCHEMBL6173698 0.83 LMNA (0.42) LMNAPOLBL3MBTL1LIPEGABRA1
SCHEMBL6172197 0.83 LMNA (0.40) LMNAPOLBL3MBTL1LIPEGABRA1
SCHEMBL6175651 0.82 GSK3B (0.41) LMNAL3MBTL1CHRM4
SCHEMBL6173186 0.81 LMNA (0.40) LMNAPOLBL3MBTL1LIPEGABRA1
SCHEMBL6173052 0.81 EPHX2 (0.36) LMNAPOLBL3MBTL1LIPECXCR3
SCHEMBL6172442 0.81 LMNA (0.40) LMNAPOLBL3MBTL1LIPEGABRA1
SCHEMBL6170501 0.81 LMNA (0.42) LMNAPOLBL3MBTL1LIPECXCR3
SCHEMBL6176359 0.80 LMNA (0.39) LMNAPOLBL3MBTL1LIPECXCR3
SCHEMBL6177656 0.80 LMNA (0.37) LMNAPOLBL3MBTL1

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