SCHEMBL11889092

SCHEMBL11889092

O=C(c1ccc(F)cc1C(F)(F)F)N1CCC(O)(C(=O)O)CC1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR183 P32249 1/20 0.52
HCRTR1 O43613 1/20 0.47
HCRTR2 O43614 1/20 0.47
SCD O00767 1/20 0.46
SMO Q99835 6/20 0.45
PSEN1 P49768 3/20 0.45
PSEN2 P49810 3/20 0.45
APH1B Q8WW43 3/20 0.45
NCSTN Q92542 3/20 0.45
APH1A Q96BI3 3/20 0.45
PSENEN Q9NZ42 3/20 0.45
NPC1 O15118 1/20 0.45
P2RX7 Q99572 1/20 0.44
CYP46A1 Q9Y6A2 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
SCHEMBL11888869 0.84 KDM4E (0.54) NPC1
SCHEMBL11888886 0.83 CYP2C9 (0.56) SCDPSEN1PSEN2APH1BNCSTN
SCHEMBL11888910 0.81 CNR1 (0.47) NPC1CYP46A1
SCHEMBL937498 0.79 GPR183 (0.50) GPR183HCRTR1HCRTR2SCDSMO
SCHEMBL30691929 0.79 GPR183 (0.50) GPR183HCRTR1HCRTR2SCDSMO
SCHEMBL1147339 0.79 EPHX2 (0.44) GPR183HCRTR1HCRTR2SCDSMO
SCHEMBL11889045 0.75 HSD11B1 (0.53) GPR183
SCHEMBL5935437 0.73 GPR119 (0.49) HCRTR1HCRTR2SCDSMOP2RX7
SCHEMBL11888882 0.72 HTT (0.60)
SCHEMBL17938731 0.72 GPR183 (0.51) GPR183HCRTR1HCRTR2SCDSMO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2480532-B1 PIPERIDINE DERIVATIVES AND THEIR USE TO TREAT OBESITY, DIABETES, DYSLIPIDEMIA AND ATHEROSCLEROSIS HOFFMANN LA ROCHE (CH) 2013-11-20 EP claimed
EP-2480532-A1 PIPERIDINE DERIVATIVES AND THEIR USE TO TREAT OBESITY, DIABETES, DYSLIPIDEMIA AND ATHEROSCLEROSIS F. Hoffmann-La Roche AG (CH) 2012-08-01 EP claimed
CN-102471265-A Piperidine derivatives and their use for the treatment of obesity, diabetes, dyslipidemia and atherosclerosis HOFFMANN LA ROCHE 2012-05-23 CN claimed
EP-2480532-B1 PIPERIDINE DERIVATIVES AND THEIR USE TO TREAT OBESITY, DIABETES, DYSLIPIDEMIA AND ATHEROSCLEROSIS HOFFMANN LA ROCHE (CH) 2013-11-20 EP disclosed
US-8399676-B2 Piperidine derivatives HOFFMAN-LA ROCHE INC. (US) 2013-03-19 US disclosed
EP-2480532-A1 PIPERIDINE DERIVATIVES AND THEIR USE TO TREAT OBESITY, DIABETES, DYSLIPIDEMIA AND ATHEROSCLEROSIS F. Hoffmann-La Roche AG (CH) 2012-08-01 EP disclosed
CN-102471265-A Piperidine derivatives and their use for the treatment of obesity, diabetes, dyslipidemia and atherosclerosis HOFFMANN LA ROCHE 2012-05-23 CN disclosed