SCHEMBL8867766

SCHEMBL8867766

O=C(NC(=O)c1ccccc1)Nc1cccc(/C=C/CO)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.57
RAB9A P51151 5/20 0.57
MEN1 O00255 1/20 0.57
KMT2A Q03164 1/20 0.57
PKM P14618 1/20 0.56
SNCA P37840 2/20 0.53
SMO Q99835 1/20 0.51
SIRT1 Q96EB6 1/20 0.50
ALDH1A1 P00352 2/20 0.49
MAPT P10636 1/20 0.49
KCNK3 O14649 1/20 0.48
KCNK9 Q9NPC2 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.46
NPSR1 Q6W5P4 1/20 0.45
MAOA P21397 3/20 0.44
MAOB P27338 3/20 0.44
HDAC3 O15379 1/20 0.44
HDAC4 P56524 1/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC7 Q8WUI4 1/20 0.44

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
SCHEMBL8867756 0.90 NPC1 (0.57) NPC1RAB9AMEN1KMT2APKM
SCHEMBL8867760 0.90 NPC1 (0.57) NPC1RAB9AMEN1KMT2APKM
SCHEMBL8867294 0.86 MAOB (0.53) NPC1RAB9AMEN1KMT2APKM
SCHEMBL8868501 0.81 MEN1 (0.47) RAB9AMEN1KMT2ASNCAALDH1A1
SCHEMBL8867685 0.80 MAOB (0.46) MEN1KMT2APKMSNCAMAPT
SCHEMBL8867672 0.79 PKM (0.55) NPC1KMT2APKMSNCASIRT1
SCHEMBL8867677 0.79 PKM (0.55) NPC1KMT2APKMSNCASIRT1
SCHEMBL8867002 0.78 PKM (0.54) NPC1RAB9AMEN1KMT2APKM
SCHEMBL8867045 0.78 KCNK3 (0.59) MEN1KMT2APKMSNCAMAPT
SCHEMBL8866604 0.78 L3MBTL1 (0.70) NPC1RAB9AMEN1KMT2APKM

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