SCHEMBL2429904

SCHEMBL2429904

CC(C)(C)OC(=O)N1CCC2(CC1)CC(c1cccc(OC(F)(F)F)c1)CO2

nearest known ligand 0.75

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 7/20 0.75
FFAR4 Q5NUL3 3/20 0.45
GPR119 Q8TDV5 1/20 0.40
IDO1 P14902 1/20 0.40
PIM1 P11309 1/20 0.39
HCRTR2 O43614 1/20 0.39
FAAH O00519 1/20 0.38
LIPE Q05469 1/20 0.38
ABHD6 Q9BV23 1/20 0.38
RORC P51449 1/20 0.38

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
SCHEMBL2428670 0.90 MGLL (0.62) MGLLFFAR4GPR119LIPEABHD6
SCHEMBL2424111 0.88 MGLL (0.59) MGLLGPR119IDO1RORC
SCHEMBL2427005 0.88 MGLL (0.59) MGLLGPR119IDO1RORC
SCHEMBL2428771 0.88 MGLL (0.59) MGLLGPR119IDO1RORC
SCHEMBL20399201 0.87 MGLL (0.76) MGLLFFAR4
SCHEMBL2427031 0.87 MGLL (0.57) MGLLIDO1RORC
SCHEMBL20397181 0.86 MGLL (1.00) MGLLFFAR4ABHD6
SCHEMBL2424183 0.85 MGLL (0.55) MGLLGPR119IDO1
SCHEMBL2427027 0.85 MGLL (0.55) MGLLGPR119IDO1
SCHEMBL2423590 0.85 MGLL (0.55) MGLLGPR119IDO1

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
EP-3571202-B1 HETEROCYCLIC SPIRO COMPOUNDS AS MAGL INHIBITORS PFIZER (US) 2021-06-30 EP disclosed
US-10858373-B2 Heterocyclic spiro compounds as MAGL inhibitors PFIZER INC. (US) 2020-12-08 US disclosed
US-20190292203-A1 HETEROCYCLIC SPIRO COMPOUNDS AS MAGL INHIBITORS PFIZER INC. (US) 2019-09-26 US disclosed
US-20180208608-A1 HETEROCYCLIC SPIRO COMPOUNDS AS MAGL INHIBITORS PFIZER (US) 2018-07-26 US disclosed
EP-2367830-A1 1-OXA-8-AZASPIRO [4, 5] DECANE- 8 -CARBOXAMIDE COMPOUNDS AS FAAH INHIBITORS Pfizer Inc. (US) 2011-09-28 EP disclosed
US-20110230493-A1 1-OXA-8-Azaspiro [4,5] Decabe-8-Carboxamide Compounds as FAAH Inhibitors PFIZER INC. 2011-09-22 US disclosed
WO-2010058318-A1 1-OXA-8-AZASPIRO [4, 5 ] DECANE- 8 -CARBOXAMIDE COMPOUNDS AS FAAH INHIBITORS PFIZER INC. (US) 2010-05-27 WO 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 (4 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-20190292203-A1 HETEROCYCLIC SPIRO COMPOUNDS AS MAGL INHIBITORS MAG, MAGI3, APC MGLL 16/4885FFAR4 3900/4885GPR119 1000/4885
US-20180208608-A1 HETEROCYCLIC SPIRO COMPOUNDS AS MAGL INHIBITORS MAG, MAGI3, APC MGLL 16/4885FFAR4 3900/4885GPR119 1000/4885
US-20110230493-A1 1-OXA-8-Azaspiro [4,5] Decabe-8-Carboxamide Compounds as FAAH Inhibitors FAAH, FAAH2, FFAR1 MGLL 246/4885FFAR4 15/4885GPR119 58/4885
US-10858373-B2 Heterocyclic spiro compounds as MAGL inhibitors MAG, MAGI3, APC MGLL 16/4885FFAR4 3900/4885GPR119 1000/4885

“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.