SCHEMBL20150068

SCHEMBL20150068

COc1ccc(CN(CCCC(=O)OC(C)(C)C)c2cc(C)ccc2C=O)cc1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSPO P30536 1/20 0.39
BCHE P06276 7/20 0.38
PPARA Q07869 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
NR1D1 P20393 1/20 0.36
ACHE P22303 6/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
POLB P06746 2/20 0.35
KDM4E B2RXH2 1/20 0.35
USP2 O75604 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35
HSD17B10 Q99714 1/20 0.35
GAA P10253 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
MEN1 O00255 1/20 0.34
HTT P42858 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL20137405 0.90 BCL2A1 (0.38) BCHENR1D1ACHEALDH1A1MEN1
SCHEMBL20151842 0.89 PPARD (0.36) TSPOPPARAHDAC8L3MBTL1POLB
SCHEMBL20151838 0.88 PPARG (0.39) TSPOBCHEACHEL3MBTL1KDM4E
SCHEMBL20137411 0.88 LTB4R2 (0.40) BCHENR1D1POLB
SCHEMBL25802749 0.81 TSPO (0.46) TSPOBCHEPPARAHDAC8NR1D1
SCHEMBL20151851 0.79 PPARD (0.33) NR1D1KDM4E
SCHEMBL20137115 0.79 LTB4R2 (0.44) BCHEACHE
SCHEMBL20137037 0.77 KDM4E (0.38) PPARAPOLBKDM4EALDH1A1MEN1
SCHEMBL20151854 0.77 NR1D1 (0.39) BCHENR1D1ALDH1A1HTT
SCHEMBL20151846 0.76 PPARD (0.38) PPARAL3MBTL1POLBKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11691975-B2 MAGL inhibitors H. LUNDBECKA/S (DK) 2023-07-04 US disclosed
US-9981930-B1 MAGL inhibitors ABIDE THERAPEUTICS, INC. (US) 2018-05-29 US disclosed
US-20180134675-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-11691975-B2 MAGL inhibitors MAG, MAGI3, MGLL TSPO 3919/4885BCHE 1581/4885PPARA 1470/4885
US-20180134675-A1 MAGL INHIBITORS MAG, MAGI3, MGLL TSPO 3700/4885BCHE 1310/4885PPARA 2252/4885

“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.