SCHEMBL20151859

SCHEMBL20151859

Cc1ccc(CN2CCN(C(=O)OC(C)(C)C)CC2)c(/C=C/CCC(=O)OC(C)(C)C)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 2/20 0.42
VEGFA P15692 1/20 0.41
EGLN1 Q9GZT9 1/20 0.41
TP53 P04637 2/20 0.40
MAPT P10636 1/20 0.38
IDO1 P14902 1/20 0.38
TDO2 P48775 1/20 0.38
IDO2 Q6ZQW0 1/20 0.38
CHRM2 P08172 1/20 0.38
CHRM4 P08173 1/20 0.38
CHRM1 P11229 1/20 0.38
CHRM3 P20309 1/20 0.38
GPR119 Q8TDV5 2/20 0.38
ENPP2 Q13822 1/20 0.38
ALDH1A1 P00352 1/20 0.37
NSD2 O96028 1/20 0.37
SETD7 Q8WTS6 1/20 0.37
GRIN2B Q13224 2/20 0.37
KDM1A O60341 1/20 0.37
MEN1 O00255 1/20 0.37

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
SCHEMBL20157882 0.88 MGLL (0.54) MGLLMAPTENPP2
SCHEMBL20151857 0.83 MGLL (0.47) MGLLVEGFAEGLN1TP53MAPT
SCHEMBL20137045 0.80 MGLL (0.50) MGLLENPP2MEN1KMT2A
SCHEMBL20137047 0.80 MGLL (0.50) MGLLENPP2MEN1KMT2A
SCHEMBL20151860 0.79 MGLL (0.48) MGLLVEGFAEGLN1TP53MAPT
SCHEMBL20151870 0.77 MGLL (0.48) MGLLVEGFAEGLN1TP53MAPT
SCHEMBL17109170 0.77 ALDH1A1 (0.58) MGLLVEGFAEGLN1TP53IDO1
SCHEMBL19386351 0.77 MGLL (0.48) MGLLVEGFAEGLN1TP53CHRM2
SCHEMBL20150071 0.77 MGLL (0.48) MGLLVEGFAEGLN1TP53CHRM2
SCHEMBL16577092 0.77 ALDH1A1 (0.54) MGLLVEGFAEGLN1TP53MAPT

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 MGLL 3/4885VEGFA 4885/4885EGLN1 1615/4885

“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.