SCHEMBL6251397

SCHEMBL6251397

CC(c1ccncc1C(=O)N1CCOCC1)C1NC(=O)N(c2ccc(OC(F)(F)F)cc2)C1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 4/20 0.39
PKM P14618 1/20 0.36
LMNA P02545 2/20 0.36
MAPK7 Q13164 1/20 0.36
LIPE Q05469 2/20 0.35
JAK2 O60674 1/20 0.35
FASN P49327 1/20 0.35
CTSS P25774 3/20 0.34
CTSK P43235 3/20 0.34
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34
KMT2A Q03164 1/20 0.34
CTSL P07711 2/20 0.34
ABL1 P00519 1/20 0.34
BCR P11274 1/20 0.34
PIK3CD O00329 1/20 0.34
PIK3R2 O00459 1/20 0.34
PIK3CA P42336 1/20 0.34
PIK3CB P42338 1/20 0.34
PIK3CG P48736 1/20 0.34

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
SCHEMBL6173052 0.92 EPHX2 (0.36) EPHX2LMNALIPEKCNA5
SCHEMBL6175577 0.91 EPHX2 (0.40) EPHX2LMNAMAPK7LIPEALDH1A1
SCHEMBL6175321 0.90 KCNA5 (0.41) LMNALIPEALDH1A1KMT2AKCNA5
SCHEMBL6170501 0.85 LMNA (0.42) EPHX2LMNALIPE
SCHEMBL6176359 0.85 LMNA (0.39) LMNALIPE
SCHEMBL6174458 0.82 SLC5A1 (0.40) PKMLMNALIPEALDH1A1
SCHEMBL6173353 0.82 LMNA (0.45) LMNALIPEALDH1A1KMT2A
SCHEMBL6172200 0.81 EPHX2 (0.40) EPHX2PKMLMNAMAPK7LIPE
SCHEMBL6175672 0.80 LIPE (0.34) PKMLMNALIPEABL1PIK3CA
SCHEMBL6173172 0.80 LMNA (0.41) LMNAABL1

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