SCHEMBL8938520

SCHEMBL8938520

O=C(c1ncc[nH]1)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CCCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
KMT2A Q03164 1/20 0.47
F2 P00734 3/20 0.42
FKBP1A P62942 1/20 0.42
PREP P48147 1/20 0.41
KDM4E B2RXH2 1/20 0.40
MAPK1 P28482 1/20 0.40

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
SCHEMBL8938415 0.83 MEN1 (0.49) MEN1NPC1RAB9AKMT2AF2
SCHEMBL8938617 0.83 DAGLA (0.49) MEN1NPC1RAB9AKMT2AF2
SCHEMBL8938620 0.83 PLA2G4A (0.48) MEN1NPC1RAB9AKMT2AF2
SCHEMBL8938488 0.83 DAGLA (0.52) MEN1NPC1RAB9AKMT2AF2
SCHEMBL8938580 0.82 MEN1 (0.50) MEN1NPC1RAB9AKMT2AF2
SCHEMBL8938439 0.81 MEN1 (0.50) MEN1NPC1RAB9AKMT2APREP
SCHEMBL8938551 0.81 MEN1 (0.47) MEN1NPC1RAB9AKMT2AF2
SCHEMBL8938648 0.81 FAAH (0.48) MEN1NPC1RAB9AKMT2AF2
SCHEMBL8938447 0.80 ACE (0.51) MEN1NPC1RAB9AKMT2AFKBP1A
SCHEMBL8938612 0.79 MEN1 (0.47) MEN1NPC1RAB9AKMT2AF2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5547978-A ENDOPEPTIDASE INHIBITORS MEIJI SEIKA KAISHA, LTD. (JP) 1996-08-20 US claimed
US-5547978-A ENDOPEPTIDASE INHIBITORS MEIJI SEIKA KAISHA, LTD. (JP) 1996-08-20 US disclosed