SCHEMBL9874068

SCHEMBL9874068

CCCCOc1ccc(C(=O)CCC(=O)N2CCC[C@H]2[C@@H](O)C(=O)O)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.53
HRH2 P25021 10/20 0.51
HRH1 P35367 10/20 0.51
THRB P10828 7/20 0.51
ALDH1A1 P00352 3/20 0.51
LMNA P02545 3/20 0.51
CYP1A2 P05177 1/20 0.51
CHRM2 P08172 1/20 0.51
CHRM4 P08173 1/20 0.51
CHRM5 P08912 1/20 0.51
CYP2D6 P10635 1/20 0.51
CYP2C9 P11712 1/20 0.51
ADRA2C P18825 1/20 0.51
DRD4 P21917 1/20 0.51
ACHE P22303 1/20 0.51
SLC6A2 P23975 1/20 0.51
HTR2A P28223 1/20 0.51
ADRA1A P35348 1/20 0.51
SLC6A3 Q01959 1/20 0.51
PDE4D Q08499 1/20 0.51

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
SCHEMBL9873842 0.82 PREP (0.62) ALDH1A1MAPTKMT2A
SCHEMBL9873839 0.82 PREP (0.62) ALDH1A1MAPTKMT2A
SCHEMBL9874002 0.81 PREP (0.49) HRH2HRH1ALDH1A1LMNACHRM2
SCHEMBL9874007 0.81 PREP (0.49) HRH2HRH1ALDH1A1LMNACHRM2
SCHEMBL9874971 0.77 L3MBTL1 (0.55) L3MBTL1HRH2HRH1THRBALDH1A1
SCHEMBL10776986 0.77 PREP (0.55) ALDH1A1LMNAMAPTSMN1; SMN2KMT2A
SCHEMBL9873491 0.75 CAPN1 (0.43) ALDH1A1LMNAHTR2AMAPTSMN1; SMN2
SCHEMBL9873469 0.75 CAPN1 (0.43) ALDH1A1LMNAHTR2AMAPTSMN1; SMN2
SCHEMBL9874715 0.74 PREP (0.57) ALDH1A1LMNASLC6A2SLC6A3HRH3
SCHEMBL9874283 0.74 PREP (0.59) ALDH1A1MAPTKMT2A

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
US-5051444-A Pyrrolidine derivatives as anti-amnesia agents SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1991-09-24 US disclosed
US-4880827-A Pyrrolidine derivatives having inhibitory action for proline specific endopepidase SUMITOMO PHARMACEUTICALS COMPANY, LTD. (JP) 1989-11-14 US disclosed
EP-0238319-A1 Pyrrolidine derivatives SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1987-09-23 EP disclosed