SCHEMBL5333814

SCHEMBL5333814

NC(=O)c1coc(-c2cc(Oc3cccc(NC(=O)O)c3)ncn2)n1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAP2K7 O14733 10/20 0.42
ALDH1A1 P00352 1/20 0.41
FLT1 P17948 1/20 0.41
TEK Q02763 1/20 0.41
KDR P35968 8/20 0.39
TNNI3K Q59H18 5/20 0.39
MAPK14 Q16539 3/20 0.38
BRAF P15056 2/20 0.38

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
SCHEMBL5448231 0.87 AURKA (0.41) MAP2K7KDRTNNI3KMAPK14BRAF
SCHEMBL5339167 0.85 ALDH1A1 (0.42) MAP2K7ALDH1A1KDRTNNI3KMAPK14
SCHEMBL5375763 0.82 KDR (0.59) KDRBRAF
SCHEMBL5336916 0.82 MAP2K7 (0.50) MAP2K7KDRTNNI3K
SCHEMBL5340417 0.80 MAP2K7 (0.46) MAP2K7ALDH1A1KDRTNNI3K
SCHEMBL5332692 0.79 MAP2K7 (0.46) MAP2K7KDRTNNI3K
SCHEMBL5416867 0.79 MAP2K7 (0.50) MAP2K7KDRTNNI3KMAPK14BRAF
SCHEMBL5318628 0.77 KDR (0.45) MAP2K7KDRTNNI3KMAPK14BRAF
SCHEMBL5451263 0.76 MAP2K7 (0.47) MAP2K7KDRTNNI3KMAPK14BRAF
SCHEMBL5372666 0.74 MAP2K7 (0.47) MAP2K7ALDH1A1KDRTNNI3K

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007076473-A2 SUBSTITUTED PYRIMIDINYLOXY UREAS USEFUL AS INHIBITORS OF PROTEIN KINASES KALYPSYS, INC. (US) 2007-07-05 WO disclosed