SCHEMBL13033718

SCHEMBL13033718

C=C1C=CC(=O)N1Cc1ccc(C)cc1

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 5/20 0.59
▸ FAAH O00519 2/20 0.59
▸ GSK3A P49840 2/20 0.50
▸ GSK3B P49841 2/20 0.50
▸ PTGS1 P23219 1/20 0.46
▸ PTGS2 P35354 1/20 0.46
▸ TP53 P04637 3/20 0.46
▸ MAPT P10636 2/20 0.46
▸ KMT2A Q03164 1/20 0.45
▸ GAA P10253 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ PARK7 Q99497 1/20 0.42
▸ RGS4 P49798 1/20 0.42
▸ LMNA P02545 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ ACHE P22303 1/20 0.40

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
SCHEMBL14286721 0.89 MGLL (0.75) MGLLFAAHGSK3AGSK3BPTGS1
SCHEMBL4800190 0.87 MGLL (0.78) MGLLFAAHGSK3AGSK3BPTGS1
SCHEMBL18909704 0.81 MGLL (0.74) MGLLFAAHGSK3AGSK3BPTGS1
SCHEMBL12993174 0.78 MGLL (0.53) MGLLFAAHGSK3AGSK3BPTGS1
SCHEMBL146412 0.76 MGLL (1.00) MGLLFAAHGSK3AGSK3BPTGS1
SCHEMBL17532637 0.75 MGLL (0.58) MGLLFAAHGSK3AGSK3BPTGS1
SCHEMBL19419960 0.72 GSK3A (0.66) MGLLFAAHGSK3AGSK3BTP53
SCHEMBL22812334 0.71 KMT2A (0.36) MGLLFAAHTP53MAPTKMT2A
SCHEMBL12704514 0.71 TP53 (0.53) MGLLFAAHTP53MAPTKMT2A
SCHEMBL9610843 0.71 MGLL (1.00) MGLLFAAHGSK3AGSK3BPTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9034798-B2 Capture compounds, collections thereof and methods for analyzing the proteome and complex compositions CAPROTEC BIOANALYTICS GMBH (DE) 2015-05-19 — — US disclosed
US-20100298168-A1 Capture compounds, collections thereof and methods for analyzing the proteome and complex compositions HK PHARMACEUTICALS, INC. 2010-11-25 — — US disclosed
US-20100248264-A1 Capture compounds, collections thereof and methods for analyzing the proteome and complex compositions HK PHARMACEUTICALS, INC. 2010-09-30 — — 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-20100298168-A1 Capture compounds, collections thereof and methods for analyzing the proteome and complex compositions CHLSN, PTMS, SRMS MGLL 2533/4885FAAH 2716/4885GSK3A 3864/4885

“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.

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