SCHEMBL6999933

SCHEMBL6999933

NC(=O)c1cc(Cl)cnc1OCC(=O)N1C2CCC1CC(Cc1ccc(F)cc1)C2

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.37
POLB P06746 1/20 0.37
KMT2A Q03164 1/20 0.37
PTGER4 P35408 1/20 0.37
PTGER2 P43116 1/20 0.37
HCRTR2 O43614 2/20 0.35
HCRTR1 O43613 1/20 0.35
KCNH2 Q12809 2/20 0.35
OPRM1 P35372 1/20 0.35
OPRD1 P41143 1/20 0.35
OPRK1 P41145 1/20 0.35
CCR1 P32246 2/20 0.35
IP6K1 Q92551 1/20 0.35
CCR3 P51677 1/20 0.34
CRHR1 P34998 1/20 0.33
CRHR2 Q13324 1/20 0.33
HTR1A P08908 1/20 0.33
DRD2 P14416 1/20 0.33
DRD4 P21917 1/20 0.33
HTR2A P28223 1/20 0.33

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
SCHEMBL7001971 0.89 MEN1 (0.38) MEN1POLBKMT2APTGER4PTGER2
SCHEMBL6760377 0.86 KCNH2 (0.40) PTGER4PTGER2HCRTR2HCRTR1KCNH2
SCHEMBL6760380 0.86 KCNH2 (0.40) PTGER4PTGER2HCRTR2HCRTR1KCNH2
SCHEMBL7000468 0.85 CCR1 (0.47) MEN1POLBKMT2ACCR1CCR3
SCHEMBL6997076 0.84 GAA (0.42) MEN1POLBKMT2AHCRTR2CCR3
SCHEMBL7001642 0.83 GRM2 (0.41) PTGER4PTGER2OPRM1OPRK1CCR1
SCHEMBL6996562 0.78 POLB (0.54) MEN1POLBKMT2ACCR1
SCHEMBL6996406 0.77 CCR1 (0.42) MEN1POLBKMT2ACCR1CCR3
SCHEMBL7000678 0.76 CCR1 (0.50) MEN1KMT2ACCR1CCR3
SCHEMBL7004493 0.76 PTGER4 (0.43) MEN1KMT2APTGER4PTGER2KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1326867-A2 BRIDGED PIPERAZINE DERIVATIVES Pfizer Products Inc. (US) 2003-07-16 EP disclosed
WO-2002032901-A2 BRIDGED PIPERAZINE DERIVATIVES PFIZER PRODUCTS INC. (US) 2002-04-25 WO disclosed