SCHEMBL20151874

SCHEMBL20151874

CC(C)(C)OC(=O)N1CCN(Cc2cc(OC3(OC=O)CC3)cc(C(F)(F)F)c2)CC1

nearest known ligand 0.75

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 9/20 0.75
TSHR P16473 4/20 0.49
CYP2D6 P10635 3/20 0.49
TACR1 P25103 1/20 0.45
USP2 O75604 5/20 0.44
CYP1A2 P05177 2/20 0.44
CYP2C19 P33261 2/20 0.44
ALDH1A1 P00352 2/20 0.43
CYP3A4 P08684 4/20 0.42
HPGD P15428 1/20 0.41
CYP2C9 P11712 1/20 0.41
HIF1A Q16665 1/20 0.39

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
SCHEMBL20151824 0.86 MGLL (1.00) MGLLCYP2D6
SCHEMBL29561180 0.85 MGLL (0.56) MGLLTSHRCYP2D6TACR1USP2
SCHEMBL20137027 0.85 MGLL (0.56) MGLLTSHRCYP2D6TACR1USP2
SCHEMBL20151875 0.80 MGLL (0.65) MGLLTSHRCYP2D6TACR1USP2
SCHEMBL20151867 0.79 TSHR (0.58) MGLLTSHRCYP2D6TACR1USP2
SCHEMBL20137044 0.78 CYP2D6 (0.54) MGLLTSHRCYP2D6TACR1USP2
SCHEMBL28936361 0.78 MGLL (0.47) MGLLTSHRCYP2D6TACR1USP2
SCHEMBL21571740 0.78 MGLL (0.54) MGLLTSHRCYP2D6TACR1USP2
SCHEMBL447202 0.78 CYP2D6 (0.53) MGLLTSHRCYP2D6TACR1USP2
SCHEMBL19974330 0.78 CYP2D6 (0.53) MGLLTSHRCYP2D6TACR1USP2

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 3/4885TSHR 4772/4885CYP2D6 3916/4885

“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.