SCHEMBL5205435

SCHEMBL5205435

CC(=O)N(N)C(=O)O.FC(F)(F)c1cccc(-c2c[nH]c(C3CCCCC3)n2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMO O15229 2/20 0.41
ADORA1 P30542 1/20 0.40
KDM1A O60341 5/20 0.39
POLB P06746 3/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
ALDH1A1 P00352 1/20 0.39
MAOB P27338 3/20 0.39
MAOA P21397 2/20 0.39
XDH P47989 2/20 0.38
PIN1 Q13526 1/20 0.38
RAB9A P51151 1/20 0.37
PIK3CD O00329 1/20 0.37
PIK3CA P42336 1/20 0.37
PIK3CG P48736 1/20 0.37
UCHL1 P09936 1/20 0.37
ITGB3 P05106 1/20 0.37
ITGA2B P08514 1/20 0.37
VCP P55072 1/20 0.37
PIM1 P11309 1/20 0.36

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
SCHEMBL5209708 0.86 KCNH2 (0.44) KMOKDM1APOLBMEN1KMT2A
SCHEMBL5207681 0.85 KMT2A (0.36) KMOADORA1POLBMEN1KMT2A
SCHEMBL5208528 0.82 POLB (0.41) KMOADORA1KDM1APOLBMEN1
SCHEMBL5207759 0.80 ADORA1 (0.43) KMOADORA1KDM1APOLBMEN1
SCHEMBL5205158 0.79 KCNH2 (0.47) KMOKDM1APOLBMEN1KMT2A
SCHEMBL5206565 0.79 KCNH2 (0.47) KMOKDM1APOLBMEN1KMT2A
SCHEMBL14608992 0.79 KCNH2 (0.47) KMOKDM1APOLBMEN1KMT2A
SCHEMBL5207210 0.78 KDM1A (0.55) KMOKDM1APOLBMEN1KMT2A
SCHEMBL5210647 0.78 TRPV3 (0.46) ADORA1KDM1APOLBMEN1KMT2A
SCHEMBL5207845 0.77 ADORA1 (0.41) KMOADORA1POLBMEN1KMT2A

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
EP-1306085-B1 2-Cyclohexyl-4-phenyl-1H-imidazole derivatives as ligands for the neuropeptide Y5 receptor NEUROGEN CORP (US) 2007-02-14 EP claimed