SCHEMBL1036364

SCHEMBL1036364

CC(C)(C)OC(=O)N1CCC(=C(Br)Br)CC1.CC(C)(C)OC(=O)N1CCC(=CBr)CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
GRM5 P41594 1/20 0.42
ESR2 Q92731 1/20 0.39
ADORA1 P30542 1/20 0.39
NR1H2 P55055 1/20 0.39
HPGD P15428 1/20 0.38
GPR119 Q8TDV5 3/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
RECQL P46063 1/20 0.36
EPHX1 P07099 1/20 0.36
MAPT P10636 2/20 0.36
KDM4E B2RXH2 1/20 0.36
THRB P10828 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
PTPN2 P17706 1/20 0.36
PTPN1 P18031 1/20 0.36
PTPN6 P29350 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
SCHEMBL4198389 0.95 GRM5 (0.39) USP2SMN1; SMN2GRM5ESR2ADORA1
SCHEMBL513246 0.91 USP2 (0.50) USP2SMN1; SMN2GRM5ESR2ADORA1
SCHEMBL1037216 0.89 USP2 (0.51) USP2SMN1; SMN2ESR2ADORA1NR1H2
SCHEMBL26079215 0.85 HPGD (0.46) USP2SMN1; SMN2GRM5ESR2ADORA1
SCHEMBL28693960 0.82 ESR2 (0.49) USP2SMN1; SMN2GRM5ESR2ADORA1
SCHEMBL28687778 0.82 ESR2 (0.49) USP2SMN1; SMN2GRM5ESR2ADORA1
SCHEMBL12253084 0.79 USP2 (0.50) USP2SMN1; SMN2ESR2ADORA1NR1H2
SCHEMBL3806258 0.77 USP2 (0.49) USP2SMN1; SMN2ESR2ADORA1NR1H2
SCHEMBL24673913 0.77 USP2 (0.51) USP2SMN1; SMN2GRM5ESR2ADORA1
SCHEMBL10253506 0.77 USP2 (0.51) USP2SMN1; SMN2GRM5ESR2ADORA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2276738-A1 ETHER BENZYLIDENE PIPERIDINE 5-MEMBERED ARYL CARBOXAMIDE COMPOUNDS USEFUL AS FAAH INHIBITORS Pfizer Inc. (US) 2011-01-26 EP disclosed
EP-2276735-A1 ETHER BENZYLIDENE PIPERIDINE ARYL CARBOXAMIDE COMPOUNDS USEFUL AS FAAH INHIBITORS Pfizer Inc. (US) 2011-01-26 EP disclosed
WO-2009127943-A1 ETHER BENZYLIDENE PIPERIDINE 5-MEMBERED ARYL CARBOXAMIDE COMPOUNDS USEFUL AS FAAH INHIBITORS PFIZER INC. (US) 2009-10-22 WO disclosed
WO-2009127944-A1 ETHER BENZYLIDENE PIPERIDINE ARYL CARBOXAMIDE COMPOUNDS USEFUL AS FAAH INHIBITORS PFIZER INC. (US) 2009-10-22 WO disclosed