SCHEMBL20137010

SCHEMBL20137010

CC(C)(C)OC(=O)N1CCN(Cc2ccc(C(F)(F)F)cc2OC2(C(=O)O)CC2)CC1

nearest known ligand 0.75

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 17/20 0.75
ABHD6 Q9BV23 3/20 0.48
CYP2D6 P10635 1/20 0.48
PLA2G7 Q13093 1/20 0.47
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
TACR1 P25103 1/20 0.44
MAPT P10636 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
SCHEMBL29561063 1.00 MGLL (0.75) MGLLABHD6CYP2D6PLA2G7MEN1
SCHEMBL20137114 0.90 MGLL (0.61) MGLLABHD6CYP2D6PLA2G7MEN1
SCHEMBL20151864 0.87 MGLL (0.56) MGLLMEN1KMT2AMAPT
SCHEMBL30459413 0.86 MGLL (0.55) MGLLABHD6PLA2G7MEN1KMT2A
SCHEMBL20570500 0.86 MGLL (0.55) MGLLABHD6PLA2G7MEN1KMT2A
SCHEMBL20137049 0.85 MGLL (1.00) MGLLABHD6CYP2D6PLA2G7
SCHEMBL29446977 0.85 MGLL (0.60) MGLL
SCHEMBL20166137 0.85 MGLL (0.60) MGLL
SCHEMBL21571693 0.83 MGLL (0.59) MGLLABHD6CYP2D6PLA2G7MEN1
SCHEMBL20158182 0.83 MGLL (0.69) MGLLABHD6CYP2D6MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110267963-B MAGL inhibitors H.隆德贝克有限公司 2022-04-01 CN disclosed
EP-3541821-A1 MAGL INHIBITORS Abide Therapeutics, Inc. (US) 2019-09-25 EP disclosed
US-10093635-B2 MAGL inhibitors ABIDE THERAPEUTICS, INC. (US) 2018-10-09 US disclosed
WO-2018093947-A1 MAGL INHIBITORS ABIDE THERAPEUTICS, INC. (US) 2018-05-24 WO disclosed
WO-2018093947-A1 MAGL INHIBITORS ABIDE THERAPEUTICS, INC. (US) 2018-05-24 WO disclosed
US-20180134674-A1 MAGL INHIBITORS H. LUNDBECK A/S (DK) 2018-05-17 US disclosed
US-20180134674-A1 MAGL INHIBITORS H. LUNDBECK A/S (DK) 2018-05-17 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 (2 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-20180134674-A1 MAGL INHIBITORS MAG, MAGI3, MGLL MGLL 3/4885ABHD6 563/4885CYP2D6 3916/4885
US-10093635-B2 MAGL inhibitors MAG, MAGI3, MGLL MGLL 3/4885ABHD6 563/4885CYP2D6 3916/4885

“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.