SCHEMBL9800487

SCHEMBL9800487

CCCCCCC(OC(=O)CCCc1ccccc1)C(=O)N1CCCC1

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FAAH O00519 13/20 0.48
MGLL Q99685 5/20 0.47
NPC1 O15118 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
REN P00797 1/20 0.42
MEN1 O00255 1/20 0.42
RAB9A P51151 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL9800485 0.83 FAAH (0.51) FAAHMGLLNPC1TDP1REN
SCHEMBL9800450 0.78 FAAH (0.53) FAAHMGLLNPC1TDP1
SCHEMBL9800495 0.77 GAA (0.52) MEN1KMT2A
SCHEMBL19618808 0.75 TLR2 (0.49) FAAHMGLLMEN1KMT2A
SCHEMBL29053791 0.74 ALDH1A1 (0.55) FAAHMGLL
SCHEMBL21257004 0.74 ALDH1A1 (0.55) FAAHMGLL
SCHEMBL16195658 0.73 PPARG (0.45) MGLLTDP1
SCHEMBL16196137 0.73 PPARG (0.45) MGLLTDP1
SCHEMBL27591032 0.73 SIRT2 (0.48) TDP1MEN1KMT2A
SCHEMBL19066563 0.72 HPGD (0.50) FAAHMGLLTDP1

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
EP-0224272-B1 PYRROLIDINYLAMIDE ESTER DERIVATIVE HAVING ANTI-PROLYL ENDOPEPTIDASE ACTIVITY, ITS SYNTHESIS AND USE AND A PHARMACEUTICAL COMPOSITION CONTAINING IT SUNTORY LIMITED (JP) 1991-02-06 EP disclosed
US-4757083-A Enzyme inhibitors SUNTORY LIMITED (JP) 1988-07-12 US disclosed
EP-0224272-A1 Pyrrolidinylamide ester derivative having anti-prolyl endopeptidase activity, its synthesis and use and a pharmaceutical composition containing it SUNTORY LIMITED (JP) 1987-06-03 EP disclosed