SCHEMBL24254462

SCHEMBL24254462

Cn1cc(C(=O)NN)c(=O)c2ccccc21

nearest known ligand 0.71

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.71
ALDH1A1 P00352 2/20 0.67
NPC1 O15118 1/20 0.62
RAB9A P51151 1/20 0.62
MAOB P27338 3/20 0.61
KDM4E B2RXH2 2/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
NR4A2 P43354 1/20 0.55
MITF O75030 1/20 0.54
MAPT P10636 1/20 0.54
KMT2A Q03164 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
POLB P06746 1/20 0.51
S1PR1 P21453 2/20 0.51
S1PR3 Q99500 2/20 0.51
HTT P42858 1/20 0.50

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
SCHEMBL30542058 1.00 LMNA (0.71) LMNAALDH1A1NPC1RAB9AMAOB
SCHEMBL6586386 0.89 NR4A2 (0.64) LMNAALDH1A1NPC1RAB9ANR4A2
SCHEMBL10341234 0.86 KDM4E (0.72) LMNAALDH1A1NPC1RAB9AMAOB
SCHEMBL4510662 0.84 LMNA (0.65) LMNAALDH1A1NPC1RAB9AMAOB
SCHEMBL10341064 0.83 KDM4E (0.71) LMNAALDH1A1NPC1RAB9AMAOB
SCHEMBL30542063 0.83 KDM4E (0.71) LMNAALDH1A1NPC1RAB9AMAOB
SCHEMBL398187 0.82 MAOB (0.75) LMNAALDH1A1NPC1RAB9AMAOB
SCHEMBL22843746 0.82 NR4A2 (0.59) LMNANR4A2KMT2A
SCHEMBL29398958 0.82 NR4A2 (0.59) LMNANR4A2KMT2A
SCHEMBL30421484 0.81 POLB (0.61) LMNAALDH1A1NPC1RAB9AMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113735769-B Quinolinone alkaloid derivative containing acylhydrazone structure at 3-position and preparation method and application thereof 太原理工大学 2023-02-28 CN claimed
CN-113735769-A Quinolinone alkaloid derivative containing acylhydrazone structure at 3-position and preparation method and application thereof 太原理工大学 2021-12-03 CN claimed
CN-113735769-B Quinolinone alkaloid derivative containing acylhydrazone structure at 3-position and preparation method and application thereof 太原理工大学 2023-02-28 CN disclosed
WO-2022035763-A1 BORON CONTAINING COMPOUNDS AND THEIR USES 5METIS, INC. (US) 2022-02-17 WO disclosed
CN-113735769-A Quinolinone alkaloid derivative containing acylhydrazone structure at 3-position and preparation method and application thereof 太原理工大学 2021-12-03 CN disclosed