SCHEMBL3094416

SCHEMBL3094416

CN(Cc1ccc(N)cc1)CC1CCCO1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 5/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ POLB P06746 1/20 0.42
▸ MAPT P10636 3/20 0.42
▸ TP53 P04637 3/20 0.42

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
SCHEMBL3094410 1.00 GAA (0.45) GAAL3MBTL1KMT2AMEN1POLB
SCHEMBL3190543 1.00 GAA (0.45) GAAL3MBTL1KMT2AMEN1POLB
SCHEMBL82476 0.87 KMT2A (0.51) GAAL3MBTL1KMT2AMEN1POLB
SCHEMBL16373718 0.85 GAA (0.59) GAAL3MBTL1KMT2AMEN1MAPT
SCHEMBL1190859 0.85 OXTR (0.51) GAAL3MBTL1KMT2AMEN1MAPT
SCHEMBL1190645 0.85 OXTR (0.51) GAAL3MBTL1KMT2AMEN1MAPT
SCHEMBL1190642 0.85 OXTR (0.51) GAAL3MBTL1KMT2AMEN1MAPT
SCHEMBL4907547 0.82 GAA (0.54) GAAL3MBTL1KMT2AMEN1MAPT
SCHEMBL4905603 0.82 GAA (0.54) GAAL3MBTL1KMT2AMEN1MAPT
SCHEMBL5316912 0.82 GAA (0.54) GAAL3MBTL1KMT2AMEN1MAPT

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
EP-1765803-B1 QUATERNARY SALT CCR2 ANTAGONISTS JANSSEN PHARMACEUTICA NV (BE) 2016-03-09 — — EP disclosed
US-7799824-B2 Quaternary salt CCR2 antagonists ORAPHARMA, INC. (US) 2010-09-21 — — US disclosed
US-20060293379-A1 Quaternary salt CCR2 antagonists KENVUE BRANDS LLC 2006-12-28 — — 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-20060293379-A1 Quaternary salt CCR2 antagonists CCR2, CCR1, CXCR2 GAA 4725/4885L3MBTL1 3739/4885KMT2A 1470/4885

“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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