SCHEMBL22811348

SCHEMBL22811348

O=C(NCC(=O)N1CCCC1C(=O)O)c1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PREP P48147 3/20 0.69
DPP4 P27487 2/20 0.69
FAP Q12884 1/20 0.69
DPP7 Q9UHL4 1/20 0.62
ACE P12821 13/20 0.61
ACE2 Q9BYF1 6/20 0.61
SMN1; SMN2 Q16637 1/20 0.54

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
SCHEMBL22209470 1.00 PREP (0.69) PREPDPP4FAPDPP7ACE
SCHEMBL22468385 0.90 NPC1 (0.61) PREPDPP4FAPDPP7ACE
SCHEMBL28661857 0.90 NPC1 (0.61) PREPDPP4FAPDPP7ACE
SCHEMBL22209433 0.88 PREP (0.55) PREPDPP4FAPDPP7ACE
SCHEMBL5313126 0.88 DPP4 (0.55) PREPDPP4FAPDPP7ACE
SCHEMBL22811389 0.88 PREP (0.55) PREPDPP4FAPDPP7ACE
SCHEMBL22811314 0.88 PREP (0.55) PREPDPP4FAPDPP7ACE
SCHEMBL22811212 0.86 DPP4 (0.56) PREPDPP4FAPDPP7ACE
SCHEMBL22209407 0.86 DPP4 (0.62) PREPDPP4FAPDPP7ACE
SCHEMBL22811103 0.85 ACE (0.54) PREPDPP4FAPDPP7ACE

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
EP-3341007-B1 MALT1 INHIBITORS AND USES THEREOF UNIV CORNELL (US) 2020-12-23 EP disclosed