SCHEMBL2668552

SCHEMBL2668552

CC(C)CCN(C(N)=O)C1CCCCC1

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.39
MMP2 P08253 1/20 0.37
MMP8 P22894 1/20 0.37
ALOX5 P09917 1/20 0.37
TP53 P04637 1/20 0.35

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
SCHEMBL2668561 0.85 PIK3CD (0.38) PIK3CDALOX5TP53
SCHEMBL8300064 0.84 PIK3CD (0.50) PIK3CDALOX5
SCHEMBL8030775 0.83 PIK3CD (0.39) PIK3CD
SCHEMBL13351518 0.81 ALDH1A1 (0.41) PIK3CD
SCHEMBL27971919 0.80 ADH1A (0.47) ALOX5
Hydrochloric Acid SCHEMBL27529969 0.79 ADH1A (0.46) ALOX5
SCHEMBL21197527 0.79 ALOX5 (0.39) ALOX5
SCHEMBL12204020 0.79 MEN1 (0.35) PIK3CDALOX5TP53
SCHEMBL2497168 0.78 ALOX5 (0.41) ALOX5
SCHEMBL30296278 0.78 ALOX5 (0.41) ALOX5

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-2377856-A1 Urea glucokinase activators NOVO NORDISK A/S (DK) 2011-10-19 EP disclosed
WO-2007006814-A1 UREA GLUCOKINASE ACTIVATORS NOVO NORDISK A/S (DK) 2007-01-18 WO disclosed