SCHEMBL1833006

SCHEMBL1833006

Cc1cc(O[C@H](C)CCC2CCN(C(=O)OC(C)(C)C)CC2)cc(C)c1Br

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 14/20 0.44
EPHX2 P34913 2/20 0.42
KDM4E B2RXH2 1/20 0.42
PKM P14618 1/20 0.42
FAAH O00519 1/20 0.41
NPC1 O15118 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
MAPK1 P28482 1/20 0.40
HTT P42858 1/20 0.40
RAB9A P51151 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL26635590 0.90 GPR119 (0.47) GPR119KDM4EPKMNPC1ALDH1A1
SCHEMBL26637294 0.90 GPR119 (0.47) GPR119KDM4EPKMNPC1ALDH1A1
SCHEMBL26636540 0.90 GPR119 (0.47) GPR119KDM4EPKMNPC1ALDH1A1
SCHEMBL26636545 0.90 GPR119 (0.47) GPR119KDM4EPKMNPC1ALDH1A1
SCHEMBL26635583 0.90 GPR119 (0.47) GPR119KDM4EPKMNPC1ALDH1A1
SCHEMBL2560698 0.85 GPR119 (0.46) GPR119KDM4EPKMALDH1A1MAPT
SCHEMBL2557716 0.83 EED (0.46) GPR119KDM4EPKMNPC1ALDH1A1
SCHEMBL1295724 0.81 GPR119 (0.62) GPR119FAAH
SCHEMBL31574979 0.81 EPHX2 (0.49) GPR119EPHX2KDM4EPKMALDH1A1
SCHEMBL31574733 0.81 EPHX2 (0.49) GPR119EPHX2KDM4EPKMALDH1A1

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-2321297-A1 PIPERIDINYL GPCR AGONISTS Prosidion Limited (GB) 2011-05-18 EP disclosed