SCHEMBL3868708

SCHEMBL3868708

NCCC(=O)N[C@H]1C[C@H]2CC[C@@H](C1)N2C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SMYD3 Q9H7B4 15/20 0.43
MEN1 O00255 1/20 0.39
MAPK1 P28482 1/20 0.39
KMT2A Q03164 1/20 0.39
GAA P10253 1/20 0.39
ALDH1A1 P00352 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL3872481 1.00 SMYD3 (0.43) SMYD3MEN1MAPK1KMT2AGAA
SCHEMBL3868710 1.00 SMYD3 (0.43) SMYD3MEN1MAPK1KMT2AGAA
SCHEMBL3878767 0.87 MEN1 (0.38) SMYD3MEN1MAPK1KMT2AGAA
SCHEMBL3875019 0.87 MEN1 (0.38) SMYD3MEN1MAPK1KMT2AGAA
SCHEMBL3875022 0.87 MEN1 (0.38) SMYD3MEN1MAPK1KMT2AGAA
SCHEMBL3876909 0.80 MEN1 (0.38) MEN1MAPK1KMT2AGAAALDH1A1
SCHEMBL3876907 0.80 MEN1 (0.38) MEN1MAPK1KMT2AGAAALDH1A1
SCHEMBL3876900 0.77 LMNA (0.40) MEN1MAPK1KMT2AGAAALDH1A1
SCHEMBL3876899 0.77 LMNA (0.40) MEN1MAPK1KMT2AGAAALDH1A1
SCHEMBL25318122 0.75 L3MBTL1 (0.39) MEN1MAPK1KMT2AGAAALDH1A1

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 4 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
EP-1891064-A1 N-AMIDE DERIVATIVES OF 8-AZABICYCLO[3.2.1]OCT-3-YL AS CCR1 ANTAGONISTS Laboratorios Almirall, S.A. (ES) 2008-02-27 EP disclosed
WO-2006133802-A1 N-AMIDE DERIVATIVES OF 8-AZABICYCLO[3.2.1]OCT-3-YL AS CCR1 ANTAGONISTS LABORATORIOS ALMIRALL, S.A. (ES) 2006-12-21 WO 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 SMYD3 1696/4885MEN1 4445/4885MAPK1 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.