SCHEMBL20157879

SCHEMBL20157879

CC(C)(C)OCCCCN(Cc1ccccc1)c1cc(C(F)(F)F)ccc1C=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
NR1H3 Q13133 3/20 0.36
NR1H2 P55055 2/20 0.36
PPARG P37231 3/20 0.36
PPARD Q03181 3/20 0.36
PPARA Q07869 3/20 0.36
NR3C1 P04150 2/20 0.36
POLB P06746 1/20 0.35
MAPT P10636 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
TMEM97 Q5BJF2 2/20 0.34
SIGMAR1 Q99720 2/20 0.34
CACNA1H O95180 1/20 0.33
CACNA1B Q00975 1/20 0.33
MTOR P42345 1/20 0.33
CETP P11597 1/20 0.32
ALKBH3 Q96Q83 1/20 0.32
LTB4R Q15722 1/20 0.32

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
SCHEMBL20137037 0.83 KDM4E (0.38) KDM4EALDH1A1NR1H3NR1H2PPARG
SCHEMBL20157948 0.83 CETP (0.36) KDM4EALDH1A1NR1H3NR1H2PPARG
Hydrochloric Acid SCHEMBL20137043 0.82 KDM4E (0.37) KDM4EALDH1A1NR1H3NR1H2PPARG
SCHEMBL29561187 0.81 FFAR4 (0.39) KDM4EALDH1A1NR1H3NR1H2PPARG
SCHEMBL20137089 0.81 FFAR4 (0.39) KDM4EALDH1A1NR1H3NR1H2PPARG
SCHEMBL20158307 0.80 CETP (0.40) KDM4EALDH1A1NR1H3NR1H2PPARG
Hydrochloric Acid SCHEMBL29560707 0.80 FFAR4 (0.39) KDM4EALDH1A1NR1H3NR1H2PPARG
Hydrochloric Acid SCHEMBL20137048 0.80 FFAR4 (0.39) KDM4EALDH1A1NR1H3NR1H2PPARG
Trifluoroacetic Acid SCHEMBL29561105 0.79 PPARG (0.39) KDM4EALDH1A1NR1H3NR1H2PPARG
SCHEMBL20137009 0.78 MGLL (0.36) KDM4EALDH1A1NR1H3NR1H2PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (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-20180134674-A1 MAGL INHIBITORS MAG, MAGI3, MGLL KDM4E 984/4885ALDH1A1 4349/4885NR1H3 2234/4885

“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.