SCHEMBL6173052

SCHEMBL6173052

CC(c1ccncc1C(=O)N1CCCCC1)C1NC(=O)N(c2ccc(OC(F)(F)F)cc2)C1=O

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 4/20 0.36
LIPE Q05469 5/20 0.36
LMNA P02545 1/20 0.36
DPP4 P27487 1/20 0.35
DPP7 Q9UHL4 1/20 0.35
CXCR3 P49682 1/20 0.34
HRH3 Q9Y5N1 2/20 0.34
POLB P06746 2/20 0.33
PDE2A O00408 1/20 0.33
KCNA5 P22460 1/20 0.33
L3MBTL1 Q9Y468 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
SCHEMBL6175577 0.93 EPHX2 (0.40) EPHX2LIPELMNAHRH3KCNA5
SCHEMBL6251397 0.92 EPHX2 (0.39) EPHX2LIPELMNAKCNA5
SCHEMBL6175321 0.90 KCNA5 (0.41) LIPELMNAKCNA5
SCHEMBL6170501 0.87 LMNA (0.42) EPHX2LIPELMNACXCR3POLB
SCHEMBL6173948 0.87 IGF1R (0.33) LMNAPOLBPDE2A
SCHEMBL6176359 0.86 LMNA (0.39) LIPELMNACXCR3POLBL3MBTL1
SCHEMBL6174458 0.84 SLC5A1 (0.40) LIPELMNACXCR3POLBL3MBTL1
SCHEMBL6173353 0.83 LMNA (0.45) LIPELMNACXCR3POLBPDE2A
SCHEMBL6171386 0.81 LMNA (0.38) LIPELMNACXCR3POLBL3MBTL1
SCHEMBL6173172 0.81 LMNA (0.41) LMNAL3MBTL1

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