SCHEMBL3876909

SCHEMBL3876909

O=C(CBr)NC1CC2CCC(C1)N2C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
MAPK1 P28482 1/20 0.38
GAA P10253 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
ALDH1A1 P00352 3/20 0.34
LMNA P02545 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CYP2D6 P10635 1/20 0.33

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
SCHEMBL3876907 1.00 MEN1 (0.38) MEN1KMT2AMAPK1GAAL3MBTL1
SCHEMBL3875019 0.83 MEN1 (0.38) MEN1KMT2AMAPK1GAAL3MBTL1
SCHEMBL3878767 0.83 MEN1 (0.38) MEN1KMT2AMAPK1GAAL3MBTL1
SCHEMBL3875022 0.83 MEN1 (0.38) MEN1KMT2AMAPK1GAAL3MBTL1
SCHEMBL3868710 0.80 SMYD3 (0.43) MEN1KMT2AMAPK1GAAALDH1A1
SCHEMBL3876899 0.80 LMNA (0.40) MEN1KMT2AMAPK1GAAL3MBTL1
SCHEMBL3868708 0.80 SMYD3 (0.43) MEN1KMT2AMAPK1GAAALDH1A1
SCHEMBL3876900 0.80 LMNA (0.40) MEN1KMT2AMAPK1GAAL3MBTL1
SCHEMBL3872481 0.80 SMYD3 (0.43) MEN1KMT2AMAPK1GAAALDH1A1
SCHEMBL25318115 0.78 L3MBTL1 (0.39) MEN1KMT2AMAPK1GAAL3MBTL1

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-1891064-B1 N-AMIDE DERIVATIVES OF 8-AZABICYCLO[3.2.1]OCT-3-YL AS CCR1 ANTAGONISTS ALMIRALL SA (ES) 2009-09-02 EP disclosed
US-20090130090-A1 N-amide Derivatives of 8-Azabicyclo[3.2.1]OCT-3-YL AS CCR1 Antagonists LABORATORIOS ALMIRALL, S.A. (ES) 2009-05-21 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-20090130090-A1 N-amide Derivatives of 8-Azabicyclo[3.2.1]OCT-3-YL AS CCR1 Antagonists CCR1, CCR3, CCR8 MEN1 4445/4885KMT2A 2987/4885MAPK1 730/4885

“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.