SCHEMBL2668670

SCHEMBL2668670

CC(O)c1c(Cl)cccc1N(CC1CCCC1)C(N)=O

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 3/20 0.36
GHSR Q92847 2/20 0.36
MEN1 O00255 1/20 0.36
LMNA P02545 1/20 0.36
KMT2A Q03164 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
PDK1 Q15118 1/20 0.35
TSHR P16473 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.33
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 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
SCHEMBL12204358 0.75 ALOX5 (0.40) ALOX5NPC1RAB9APDK1SLC6A2
SCHEMBL2668587 0.74 ALOX5 (0.41) ALOX5MEN1LMNAKMT2ASLC6A2
SCHEMBL2668511 0.73 NPC1 (0.41) ALOX5MEN1KMT2ANPC1RAB9A
SCHEMBL12204197 0.73 ALOX5 (0.40) ALOX5MEN1LMNAKMT2ATSHR
SCHEMBL2668512 0.70 NPC1 (0.47) ALOX5NPC1RAB9APDK1ALDH1A1
SCHEMBL8817753 0.69 MEN1 (0.39) GHSRMEN1LMNAKMT2ANPC1
SCHEMBL2668428 0.68 ALDH1A1 (0.41) ALOX5KMT2APDK1L3MBTL1ALDH1A1
SCHEMBL2668510 0.67 NPSR1 (0.44) ALOX5KMT2ANPSR1NPC1RAB9A
SCHEMBL12204347 0.67 CXCR4 (0.41) MEN1LMNAKMT2ANPSR1NPC1
SCHEMBL11138539 0.66 OPRM1 (0.36) ALOX5NPSR1NPC1RAB9APDK1

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-2007006814-A1 UREA GLUCOKINASE ACTIVATORS NOVO NORDISK A/S (DK) 2007-01-18 WO disclosed