SCHEMBL2606355

SCHEMBL2606355

NC(=O)N(C1CCCCC1)C1CCC(=O)CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.39
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
LMNA P02545 1/20 0.38
ALOX15 P16050 1/20 0.38
ALOX12 P18054 1/20 0.38
RECQL P46063 1/20 0.38
ADAM17 P78536 1/20 0.38
KMT2A Q03164 1/20 0.38
ALOX5 P09917 3/20 0.37
S1PR1 P21453 5/20 0.37
PHGDH O43175 1/20 0.36
S1PR3 Q99500 8/20 0.36
GAA P10253 1/20 0.36
TRPM8 Q7Z2W7 1/20 0.35
ALDH1A1 P00352 1/20 0.35
SPHK1 Q9NYA1 1/20 0.35
TSHR P16473 1/20 0.35
XBP1 P17861 1/20 0.35
NPSR1 Q6W5P4 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
SCHEMBL11234464 0.87 ALOX5 (0.45) HSD11B1KDM4EMEN1LMNAALOX15
SCHEMBL19458771 0.87 ALOX5 (0.45) HSD11B1KDM4EMEN1LMNAALOX15
SCHEMBL2606404 0.87 ALOX5 (0.45) HSD11B1KDM4EMEN1LMNAALOX15
SCHEMBL2754 0.87 ALOX5 (0.45) HSD11B1KDM4EMEN1LMNAALOX15
Hydrochloric Acid SCHEMBL13518199 0.85 ALOX5 (0.43) HSD11B1KDM4EMEN1LMNAALOX15
Urea SCHEMBL2807369 0.85 ALOX5 (0.43) HSD11B1KDM4EMEN1LMNAALOX15
SCHEMBL2170733 0.85 ALOX5 (0.43) HSD11B1KDM4EMEN1LMNAALOX15
SCHEMBL9547539 0.82 ALOX5 (0.44) HSD11B1KDM4EMEN1LMNAALOX15
SCHEMBL9072498 0.82 PHGDH (0.35) HSD11B1KDM4EMEN1LMNAALOX15
Cyclohexylamine SCHEMBL27429394 0.79 ALOX5 (0.39) HSD11B1KDM4EMEN1LMNAALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1723128-B1 HETEROARYL-UREAS AND THEIR USE AS GLUCOKINASE ACTIVATORS NOVO NORDISK AS (DK) 2012-11-07 EP disclosed
EP-2444397-A1 Heteroaryl-ureas and their use as glucokinase activators Novo Nordisk A/S (DK) 2012-04-25 EP disclosed
WO-2005066145-A1 HETEROARYL-UREAS AND THEIR USE AS GLUCOKINASE ACTIVATORS NOVO NORDISK A/S (DK) 2005-07-21 WO disclosed