SCHEMBL20137044

SCHEMBL20137044

CC(C)(C)OC(=O)N1CCN(Cc2cc(O)cc(C(F)(F)F)c2)CC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.54
TSHR P16473 1/20 0.54
MGLL Q99685 4/20 0.53
TACR1 P25103 2/20 0.51
USP2 O75604 4/20 0.48
CYP1A2 P05177 2/20 0.48
CYP2C19 P33261 2/20 0.48
ALDH1A1 P00352 2/20 0.47
MAPT P10636 1/20 0.46
STS P08842 1/20 0.45
HPGD P15428 1/20 0.45
VEGFA P15692 1/20 0.44
EGLN1 Q9GZT9 1/20 0.44
CYP2C9 P11712 1/20 0.43
GLS O94925 1/20 0.43
IDO1 P14902 1/20 0.43
TDO2 P48775 1/20 0.43
IDO2 Q6ZQW0 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
CYP3A4 P08684 1/20 0.43

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
SCHEMBL20151867 0.89 TSHR (0.58) CYP2D6TSHRMGLLTACR1USP2
SCHEMBL12442050 0.89 VEGFA (0.50) MGLLUSP2ALDH1A1MAPTVEGFA
SCHEMBL5570585 0.89 VEGFA (0.50) MGLLUSP2ALDH1A1MAPTVEGFA
SCHEMBL19974330 0.87 CYP2D6 (0.53) CYP2D6TSHRMGLLTACR1USP2
SCHEMBL447202 0.87 CYP2D6 (0.53) CYP2D6TSHRMGLLTACR1USP2
SCHEMBL20137136 0.86 CYP2D6 (0.52) CYP2D6TSHRMGLLTACR1USP2
SCHEMBL20503443 0.84 CYP2D6 (0.50) CYP2D6TSHRMGLLTACR1USP2
SCHEMBL8535869 0.83 FAAH (0.60) MGLLTACR1ALDH1A1GLS
SCHEMBL1657753 0.83 CYP2D6 (0.52) CYP2D6TSHRMGLLTACR1USP2
SCHEMBL20567070 0.83 VEGFA (0.53) MGLLSTSVEGFAEGLN1GLS

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 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11332453-B2 MAGL inhibitors H. LUNDBECK A/S (DK) 2022-05-17 US disclosed
US-11332453-B2 MAGL inhibitors H. LUNDBECK A/S (DK) 2022-05-17 US disclosed
CN-110267963-B MAGL inhibitors H.隆德贝克有限公司 2022-04-01 CN disclosed
US-11214557-B2 MAGL inhibitors H. LUNDBECK A/S (DK) 2022-01-04 US disclosed
US-11214557-B2 MAGL inhibitors H. LUNDBECK A/S (DK) 2022-01-04 US disclosed
CN-108601769-B Pyrazole compounds and methods of making and using the same H.隆德贝克有限公司 2021-09-03 CN disclosed
US-20210206735-A1 MAGL INHIBITORS LUNDBECK LA JOLLA RESEARCH CENTER, INC. (US) 2021-07-08 US disclosed
US-20210206735-A1 MAGL INHIBITORS LUNDBECK LA JOLLA RESEARCH CENTER, INC. (US) 2021-07-08 US disclosed
CN-112088001-A MAGL inhibitors 隆德贝克拉荷亚研究中心有限公司 2020-12-15 CN disclosed
EP-3377060-B1 PYRAZOLE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND USES THEREOF LUNDBECK LA JOLLA RESEARCH CENTER INC (US) 2020-08-19 EP disclosed
US-20190352273-A1 MAGL INHIBITORS H. LUNDBECK A/S (DK) 2019-11-21 US disclosed
EP-3541821-A1 MAGL INHIBITORS Abide Therapeutics, Inc. (US) 2019-09-25 EP disclosed
US-20190256494-A1 PYRAZOLE COMPOUNDS AND METHODS OF MAKING AND USING SAME H. LUNDBECK A/S (DK) 2019-08-22 US disclosed
US-10093635-B2 MAGL inhibitors ABIDE THERAPEUTICS, INC. (US) 2018-10-09 US disclosed
EP-3377060-A1 PYRAZOLE COMPOUNDS AND METHODS OF MAKING AND USING SAME Abide Therapeutics, Inc. (US) 2018-09-26 EP 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
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 (7 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 CYP2D6 3916/4885TSHR 4772/4885MGLL 3/4885
US-20210206735-A1 MAGL INHIBITORS MAG, MAGI3, MGLL CYP2D6 3916/4885TSHR 4772/4885MGLL 3/4885
US-11332453-B2 MAGL inhibitors MAG, MAGI3, MGLL CYP2D6 3916/4885TSHR 4772/4885MGLL 3/4885
US-20190352273-A1 MAGL INHIBITORS MAG, MAGI3, MGLL CYP2D6 3916/4885TSHR 4772/4885MGLL 3/4885
US-11214557-B2 MAGL inhibitors MAG, MAGI3, MGLL CYP2D6 3916/4885TSHR 4772/4885MGLL 3/4885
US-20190256494-A1 PYRAZOLE COMPOUNDS AND METHODS OF MAKING AND USING SAME ABHD6, ABHD16A, RABL6 CYP2D6 31/4885TSHR 4703/4885MGLL 21/4885
US-10093635-B2 MAGL inhibitors MAG, MAGI3, MGLL CYP2D6 3916/4885TSHR 4772/4885MGLL 3/4885

“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.