SCHEMBL2181609

SCHEMBL2181609

CN(C)C(=O)n1ccc(-c2ccccc2)n1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN4A P35499 3/20 0.62
KMT2A Q03164 5/20 0.50
SCN9A Q15858 2/20 0.46
RAB9A P51151 5/20 0.44
SMN1; SMN2 Q16637 5/20 0.44
NPC1 O15118 3/20 0.44
KDM4E B2RXH2 2/20 0.44
HPGD P15428 2/20 0.44
NFKB1 P19838 1/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44
BCHE P06276 1/20 0.43
ACHE P22303 1/20 0.43
LIPE Q05469 1/20 0.43
MGLL Q99685 3/20 0.42
TRPV1 Q8NER1 1/20 0.42
DAGLA Q9Y4D2 1/20 0.42
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 3/20 0.40
MAPT P10636 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
SCHEMBL426663 0.86 SCN4A (0.48) SCN4AKMT2ASCN9ARAB9ASMN1; SMN2
SCHEMBL427262 0.83 SCN4A (0.49) SCN4AKMT2ASCN9ARAB9ASMN1; SMN2
SCHEMBL22341331 0.80 SCN4A (0.55) SCN4AKMT2ASCN9ARAB9ASMN1; SMN2
SCHEMBL27795462 0.77 SCN4A (0.74) SCN4AKMT2ASCN9ARAB9ASMN1; SMN2
SCHEMBL1384380 0.77 SCN4A (1.00) SCN4ASCN9AMGLL
SCHEMBL7901000 0.76 SCN4A (0.43) SCN4AKMT2ASCN9ARAB9ASMN1; SMN2
SCHEMBL17224648 0.76 KMT2A (0.68) SCN4AKMT2ASCN9ARAB9ASMN1; SMN2
SCHEMBL11621690 0.75 KMT2A (0.45) SCN4AKMT2ARAB9ASMN1; SMN2NPC1
SCHEMBL11620754 0.73 KMT2A (0.46) SCN4AKMT2ASCN9ARAB9ASMN1; SMN2
SCHEMBL22492988 0.73 KMT2A (0.53) SCN4AKMT2ASCN9ARAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160139162-A1 Inhibitors Of Fatty Acid Amide Hydrolase And Monoacylglycerol Lipase For Modulation Of Cannabinoid Receptors NORTHEASTERN UNIVERSITY 2016-05-19 US disclosed
US-20160139162-A1 Inhibitors Of Fatty Acid Amide Hydrolase And Monoacylglycerol Lipase For Modulation Of Cannabinoid Receptors NORTHEASTERN UNIVERSITY 2016-05-19 US disclosed
US-20160139162-A1 Inhibitors Of Fatty Acid Amide Hydrolase And Monoacylglycerol Lipase For Modulation Of Cannabinoid Receptors NORTHEASTERN UNIVERSITY 2016-05-19 US disclosed
US-9271962-B2 Inhibitors of fatty acid amide hydrolase and monoacylglycerol lipase for modulation of cannabinoid receptors NORTHEASTERN UNIVERSITY (US) 2016-03-01 US disclosed
US-9271962-B2 Inhibitors of fatty acid amide hydrolase and monoacylglycerol lipase for modulation of cannabinoid receptors NORTHEASTERN UNIVERSITY (US) 2016-03-01 US disclosed
US-9271962-B2 Inhibitors of fatty acid amide hydrolase and monoacylglycerol lipase for modulation of cannabinoid receptors NORTHEASTERN UNIVERSITY (US) 2016-03-01 US disclosed
US-20110166138-A1 Inhibitors of Fatty Acid Amide Hydrolase and Monoacylglycerol Lipase for Modulation of Cannabinoid Receptors NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2011-07-07 US disclosed
US-20110166138-A1 Inhibitors of Fatty Acid Amide Hydrolase and Monoacylglycerol Lipase for Modulation of Cannabinoid Receptors NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2011-07-07 US disclosed
US-20110166138-A1 Inhibitors of Fatty Acid Amide Hydrolase and Monoacylglycerol Lipase for Modulation of Cannabinoid Receptors NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2011-07-07 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110166138-A1 Inhibitors of Fatty Acid Amide Hydrolase and Monoacylglycerol Lipase for Modulation of Cannabinoid Receptors FAAH, FAAH2, MGLL SCN4A 2931/4885KMT2A 2131/4885SCN9A 2233/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.