SCHEMBL6175153

SCHEMBL6175153

CC(c1ccncc1NC(=O)c1cccc(Cl)c1)C1NC(=O)N(c2ccc(OC(F)(F)F)cc2)C1=O

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LIPE Q05469 1/20 0.43
ABL1 P00519 10/20 0.40
GSK3A P49840 1/20 0.39
GSK3B P49841 1/20 0.39
POLB P06746 1/20 0.37
NTRK1 P04629 1/20 0.37
BRAF P15056 1/20 0.37
TEK Q02763 1/20 0.36
GRM5 P41594 2/20 0.36
RAF1 P04049 1/20 0.36

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
SCHEMBL6173116 0.88 KCNK2 (0.38) ABL1GSK3BPOLBBRAFTEK
SCHEMBL6172433 0.87 GAA (0.38) ABL1GSK3BPOLBBRAFGRM5
SCHEMBL6174987 0.87 GAA (0.41) ABL1GSK3AGSK3BPOLB
SCHEMBL6277100 0.87 GSK3A (0.38) LIPEABL1GSK3AGSK3B
SCHEMBL6177285 0.86 TDP1 (0.42) LIPEGSK3AGSK3B
SCHEMBL6171763 0.85 LMNA (0.38) LIPEABL1GSK3AGSK3BPOLB
SCHEMBL6176663 0.84 LMNA (0.39) ABL1GSK3AGSK3BPOLBNTRK1
SCHEMBL6174451 0.83 LMNA (0.40) LIPEABL1GSK3AGSK3B
SCHEMBL6175302 0.83 GRM5 (0.45) LIPEABL1NTRK1BRAFGRM5
SCHEMBL6174779 0.83 LMNA (0.36) LIPEABL1GSK3AGSK3BPOLB

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