SCHEMBL9045362

SCHEMBL9045362

N#C[C@@H]1CSCN1C(=O)[C@@H]1NCCC1C(=O)[C@@H]1CCc2ccccc2C1

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PREP P48147 10/20 0.44
DPP4 P27487 4/20 0.34
FAP Q12884 1/20 0.34
DPP8 Q6V1X1 1/20 0.34
FAAH O00519 4/20 0.34

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
SCHEMBL9049641 1.00 PREP (0.44) PREPDPP4FAPDPP8FAAH
SCHEMBL9051819 0.95 PREP (0.43) PREPDPP4FAPDPP8
SCHEMBL9048078 0.84 PREP (0.52) PREPDPP4FAPDPP8
SCHEMBL9048922 0.84 PREP (0.52) PREPDPP4FAPDPP8
SCHEMBL9050174 0.84 PREP (0.54) PREP
SCHEMBL9049570 0.83 PREP (0.52) PREPDPP4
SCHEMBL9051117 0.83 PREP (0.49) PREPDPP4
SCHEMBL9050430 0.83 PREP (0.49) PREPDPP4
SCHEMBL9049633 0.82 PREP (0.42) PREPDPP4FAPDPP8FAAH
SCHEMBL9045355 0.82 PREP (0.42) PREPDPP4FAPDPP8FAAH

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-0536399-B1 NOVEL ARYLALKANOYLAMINE DERIVATIVE AND DRUG CONTAINING THE SAME ZERIA PHARM CO LTD (JP) 1996-01-24 EP disclosed
US-5407950-A Brain disorders, senile dementia ZERIA PHARMACEUTICAL CO., LTD. (JP) 1995-04-18 US disclosed
EP-0536399-A1 NOVEL ARYLALKANOYLAMINE DERIVATIVE AND DRUG CONTAINING THE SAME ZERIA PHARMACEUTICAL CO., LTD. (JP) 1993-04-14 EP disclosed