SCHEMBL20397239

SCHEMBL20397239

N#Cc1ccc(C2COC3(CCN(C(=O)O)CC3)C2)cc1

nearest known ligand 0.70

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 4/20 0.70
TSHR P16473 2/20 0.39
MEN1 O00255 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
KMT2A Q03164 1/20 0.39
USP30 Q70CQ3 4/20 0.38
CYP2D6 P10635 1/20 0.38
SCD5 Q86SK9 1/20 0.38
USP2 O75604 1/20 0.36
CYP3A4 P08684 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HSD11B1 P28845 1/20 0.36
ADAM10 O14672 1/20 0.36
MMP2 P08253 1/20 0.36
TRPM8 Q7Z2W7 1/20 0.36
FASN P49327 2/20 0.36
FAAH O00519 1/20 0.35
EPHX2 P34913 1/20 0.35

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
SCHEMBL20396171 0.86 MGLL (0.54) MGLLTSHRCYP1A2CYP2C9USP30
SCHEMBL20396143 0.86 MGLL (0.54) MGLLTSHRCYP1A2CYP2C9USP30
SCHEMBL3346282 0.85 MGLL (0.51) MGLL
SCHEMBL3350922 0.85 MGLL (0.51) MGLL
SCHEMBL3346286 0.85 MGLL (0.51) MGLL
SCHEMBL18446074 0.84 MGLL (0.50) MGLLHSD11B1EPHX2
SCHEMBL20399225 0.83 MGLL (0.71) MGLLCYP3A4
SCHEMBL20397222 0.82 MGLL (1.00) MGLL
SCHEMBL20396043 0.82 MGLL (0.51) MGLLUSP30FASN
SCHEMBL20395979 0.82 MGLL (0.51) MGLLUSP30FASN

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 2 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 claimed
US-20180208608-A1 HETEROCYCLIC SPIRO COMPOUNDS AS MAGL INHIBITORS PFIZER (US) 2018-07-26 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-20180208608-A1 HETEROCYCLIC SPIRO COMPOUNDS AS MAGL INHIBITORS MAG, MAGI3, APC MGLL 16/4885TSHR 4221/4885MEN1 211/4885

“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.