SCHEMBL8867757

SCHEMBL8867757

NNC(=O)Nc1cccc(/C=C/C[O])c1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.49
MAOB P27338 4/20 0.43
MAOA P21397 3/20 0.43
PKM P14618 2/20 0.43
DDX3X O00571 1/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
MMP1 P03956 1/20 0.41
MMP2 P08253 1/20 0.41
MMP9 P14780 1/20 0.41
SNCA P37840 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
LMNA P02545 2/20 0.39
MAPT P10636 2/20 0.39
HTT P42858 1/20 0.39
MGLL Q99685 1/20 0.38
HSP90AA1 P07900 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38

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
SCHEMBL8867761 1.00 ALDH1A1 (0.49) ALDH1A1MAOBMAOAPKMDDX3X
SCHEMBL8867284 0.87 MAOB (0.53) MAOBMAOAPKMMEN1KMT2A
SCHEMBL8867288 0.87 MAOB (0.53) MAOBMAOAPKMMEN1KMT2A
SCHEMBL8867682 0.85 MAOB (0.46) ALDH1A1MAOBMAOAPKMMEN1
SCHEMBL8867679 0.85 MAOB (0.46) ALDH1A1MAOBMAOAPKMMEN1
SCHEMBL8866952 0.83 MAPT (0.46) MAOBMAOAPKMMEN1KMT2A
SCHEMBL8866959 0.83 MAPT (0.46) MAOBMAOAPKMMEN1KMT2A
SCHEMBL8867739 0.83 MAOA (0.44) ALDH1A1MAOBMAOAPKMMEN1
SCHEMBL8867734 0.83 MAOA (0.44) ALDH1A1MAOBMAOAPKMMEN1
SCHEMBL8867857 0.82 CA1 (0.51) ALDH1A1MAOBMAOAPKMMEN1

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
US-5686484-A ANTHELMINTICS, ACARICIDES, INSECTICIDES SANKYO CO., LTD. (JP) 1997-11-11 US disclosed