SCHEMBL8153245

SCHEMBL8153245

O=C[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CCCc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.55
NPC1 O15118 1/20 0.55
RAB9A P51151 1/20 0.55
KMT2A Q03164 1/20 0.55
F2 P00734 1/20 0.49
PREP P48147 1/20 0.47

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
SCHEMBL8153242 1.00 MEN1 (0.55) MEN1NPC1RAB9AKMT2AF2
SCHEMBL10507275 0.90 NPC1 (0.62) MEN1NPC1RAB9AKMT2APREP
SCHEMBL10507283 0.90 NPC1 (0.62) MEN1NPC1RAB9AKMT2APREP
SCHEMBL7372462 0.88 MEN1 (0.50) MEN1NPC1RAB9AKMT2AF2
SCHEMBL9774377 0.87 PREP (0.66) MEN1NPC1RAB9AKMT2APREP
SCHEMBL10509401 0.87 MEN1 (0.57) MEN1NPC1RAB9AKMT2APREP
SCHEMBL10509400 0.87 MEN1 (0.57) MEN1NPC1RAB9AKMT2APREP
SCHEMBL10506399 0.85 MEN1 (0.56) MEN1NPC1RAB9AKMT2APREP
SCHEMBL6285952 0.84 PREP (0.65) MEN1NPC1RAB9AKMT2APREP
SCHEMBL6285958 0.84 PREP (0.65) MEN1NPC1RAB9AKMT2APREP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6017929-A Cholinesterase activator ZERIA PHARMACEUTICAL CO., LTD. (JP) 2000-01-25 US disclosed
EP-0754454-A1 CHOLINESTERASE ACTIVATOR ZERIA PHARMACEUTICAL CO., LTD. (JP) 1997-01-22 EP disclosed
US-4912128-A Inhibiting endopeptidase HOECHST AKTIENGESELLSCHAFT (DE) 1990-03-27 US disclosed
EP-0286927-A2 Pyrrolidine-2-(1,3-dicarbonyl) derivatives, process for their preparation, agents containing them as well as their use HOECHST AKTIENGESELLSCHAFT (DE) 1988-10-19 EP disclosed