SCHEMBL6170501

SCHEMBL6170501

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

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.42
POLB P06746 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CXCR3 P49682 3/20 0.35
NTRK1 P04629 1/20 0.35
KDM4C Q9H3R0 4/20 0.34
KDM5A P29375 1/20 0.34
KDM5B Q9UGL1 1/20 0.34
EPHX2 P34913 1/20 0.34
DHODH Q02127 1/20 0.34
PDE5A O76074 1/20 0.34
LIPE Q05469 2/20 0.33
HPD P32754 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
KDM6B O15054 1/20 0.33
MAPT P10636 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
SCHEMBL6176359 0.92 LMNA (0.39) LMNAPOLBL3MBTL1CXCR3LIPE
SCHEMBL6173353 0.90 LMNA (0.45) LMNAPOLBL3MBTL1CXCR3KDM4C
SCHEMBL6174458 0.89 SLC5A1 (0.40) LMNAPOLBL3MBTL1CXCR3LIPE
SCHEMBL6173172 0.88 LMNA (0.41) LMNAL3MBTL1NPC1RAB9AMAPT
SCHEMBL6173052 0.87 EPHX2 (0.36) LMNAPOLBL3MBTL1CXCR3EPHX2
SCHEMBL6175577 0.86 EPHX2 (0.40) LMNAEPHX2LIPE
SCHEMBL6251397 0.85 EPHX2 (0.39) LMNAEPHX2LIPE
SCHEMBL6173698 0.85 LMNA (0.42) LMNAPOLBL3MBTL1CXCR3KDM4C
SCHEMBL6175321 0.85 KCNA5 (0.41) LMNALIPEMAPT
SCHEMBL6171763 0.84 LMNA (0.38) LMNAPOLBL3MBTL1CXCR3NTRK1

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