SCHEMBL8634383

SCHEMBL8634383

O=CC1CSCN1C(=O)C1CCCCC1C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PREP P48147 2/20 0.34
▸ KEAP1 Q14145 6/20 0.34
▸ NFE2L2 Q16236 4/20 0.34
▸ PEPD P12955 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ ACE P12821 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
SCHEMBL8634381 1.00 PREP (0.34) PREPKEAP1NFE2L2PEPDATM
SCHEMBL8634379 1.00 PREP (0.34) PREPKEAP1NFE2L2PEPDATM
SCHEMBL8632689 0.76 ACE (0.43) KEAP1ACE
SCHEMBL8632684 0.76 ACE (0.43) KEAP1ACE
SCHEMBL8632690 0.76 ACE (0.43) KEAP1ACE
SCHEMBL9409966 0.75 ACE (0.37) PREPACE
SCHEMBL9409960 0.75 ACE (0.37) PREPACE
SCHEMBL7321743 0.74 F2 (0.50) —
SCHEMBL7374895 0.73 CTSK (0.40) PREP
Formic Acid SCHEMBL28363706 0.66 PEPD (0.46) PEPD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5847155-A Aromatic pyrrolidine amide prolyl endopeptidase inhibitors PFIZER INC (US) 1998-12-08 — — US disclosed
Send feedback