SCHEMBL20141494

SCHEMBL20141494

O=C(O)N1CCN(c2ccc(F)cn2)CC1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.53
ME2 P23368 3/20 0.52
ME1 P48163 3/20 0.52
ME3 Q16798 3/20 0.52
CHRM1 P11229 1/20 0.49
SLC27A1 Q6PCB7 4/20 0.47
KDM4E B2RXH2 1/20 0.47
PKM P14618 1/20 0.47
PPARG P37231 1/20 0.46
GRM1 Q13255 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
LMNA P02545 1/20 0.46
MAPT P10636 1/20 0.46
HTT P42858 1/20 0.46
AKR1C3 P42330 1/20 0.46
HPGD P15428 1/20 0.45

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
SCHEMBL31589397 0.88 HTR1A (0.52) ME2ME1ME3KDM4EPKM
SCHEMBL20804512 0.86 ALDH1A1 (0.56) HRH3ME2ME1ME3CHRM1
SCHEMBL22105683 0.86 AOC3 (0.53) HRH3ME2ME1ME3CHRM1
SCHEMBL31590771 0.83 MGLL (0.61) ME2ME1ME3KDM4EPKM
SCHEMBL31589274 0.83 MGLL (0.53) ME2ME1ME3KDM4E
SCHEMBL21551525 0.82 ME2 (0.66) ME2ME1ME3SMN1; SMN2LMNA
SCHEMBL22105560 0.82 KDM4E (0.52) HRH3ME2ME1ME3CHRM1
SCHEMBL2456399 0.81 ME2 (0.47) ME2ME1ME3KDM4ESMN1; SMN2
SCHEMBL3832779 0.81 ME2 (0.47) ME2ME1ME3KDM4ESMN1; SMN2
SCHEMBL16397570 0.81 PANK3 (0.57) ME2ME1ME3CHRM1PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1798735-A 1-aryl-4- (aryloxycarbonyl) -piperazine derivatives as inhibitors of hormone sensitive lipase NOVO NORDISK AS (DK) 2006-07-05 CN claimed
WO-2018089433-A1 PHENYL mTORC INHIBITORS AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. (US) 2018-05-17 WO disclosed
CN-1798735-A 1-aryl-4- (aryloxycarbonyl) -piperazine derivatives as inhibitors of hormone sensitive lipase NOVO NORDISK AS (DK) 2006-07-05 CN disclosed