SCHEMBL14722720

SCHEMBL14722720

CC(C)(C)OC(=O)NC1CNCC1c1ccccc1F

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.44
KDM1A O60341 3/20 0.42
MAOB P27338 2/20 0.42
SSTR4 P31391 3/20 0.39
MAOA P21397 1/20 0.37
NFKB1 P19838 2/20 0.36
NFKB2 Q00653 2/20 0.36
RELA Q04206 2/20 0.36
CTSS P25774 1/20 0.36
CTSK P43235 1/20 0.36
SSTR1 P30872 1/20 0.36
KMT2A Q03164 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
SCN9A Q15858 1/20 0.36
KCNA3 P22001 1/20 0.35
HDAC4 P56524 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
GAA P10253 2/20 0.35
REN P00797 1/20 0.35
LMNA P02545 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
SCHEMBL458054 1.00 EPHX2 (0.44) EPHX2KDM1AMAOBSSTR4MAOA
SCHEMBL458426 0.91 EPHX2 (0.40) EPHX2KDM1AMAOBSSTR4MAOA
SCHEMBL121035 0.90 SSTR4 (0.46) EPHX2KDM1AMAOBSSTR4SSTR1
SCHEMBL145666 0.86 FPR1 (0.44) EPHX2KDM1AMAOBMAOAKCNH2
SCHEMBL145667 0.86 FPR1 (0.44) EPHX2KDM1AMAOBMAOAKCNH2
SCHEMBL145665 0.86 FPR1 (0.44) EPHX2KDM1AMAOBMAOAKCNH2
SCHEMBL146483 0.86 KDM1A (0.40) EPHX2KDM1AMAOBMAOANFKB1
SCHEMBL146482 0.86 KDM1A (0.40) EPHX2KDM1AMAOBMAOANFKB1
SCHEMBL146484 0.86 KDM1A (0.40) EPHX2KDM1AMAOBMAOANFKB1
SCHEMBL458267 0.85 KDM1A (0.39) EPHX2KDM1AMAOBSSTR4MAOA

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-2013026587-A1 1,4 DISUBSTITUTED PYRROLIDINE - 3 - YL -AMINE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF METABOLIC DISORDERS PROSIDION LIMITED (GB) 2013-02-28 WO disclosed