SCHEMBL5483612

SCHEMBL5483612

CC(C)(C)OC(=O)N1CCCCC1CCNc1ncc(Cl)n(CCO)c1=O

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.39
PDE8B O95263 1/20 0.37
ALOX5AP P20292 1/20 0.37
FEN1 P39748 1/20 0.37
CHEK2 O96017 1/20 0.37
IRAK4 Q9NWZ3 1/20 0.36
GRM5 P41594 3/20 0.36
KDM1A O60341 1/20 0.36
PRMT5 O14744 1/20 0.35
ALDH1A1 P00352 1/20 0.35
PDE7B Q9NP56 1/20 0.35
TRPV1 Q8NER1 2/20 0.35
METTL3 Q86U44 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
SCHEMBL5484745 0.90 ATM (0.39) ATMPDE8BALOX5APFEN1CHEK2
SCHEMBL5475019 0.90 ATM (0.37) ATMPDE8BALOX5APFEN1CHEK2
SCHEMBL8294709 0.89 CHEK2 (0.36) ATMPDE8BALOX5APFEN1CHEK2
SCHEMBL5479174 0.89 ATM (0.39) ATMPDE8BALOX5APFEN1CHEK2
SCHEMBL5483406 0.88 ALOX5AP (0.39) ATMALOX5APFEN1CHEK2IRAK4
SCHEMBL5475153 0.86 F2 (0.36) IRAK4GRM5ALDH1A1
SCHEMBL5479136 0.83 CAMK2D (0.37)
SCHEMBL8293870 0.82 ATM (0.40) ATMPDE8BALOX5APFEN1CHEK2
SCHEMBL5475212 0.82 ATM (0.37) ATMPDE8BALOX5APFEN1CHEK2
SCHEMBL5479053 0.81 ALDH1A1 (0.37) CHEK2IRAK4GRM5PRMT5ALDH1A1

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
US-20070099927-A1 Aminoalkyl-pyrazinones and-pyridones as thrombin inhibitors SANTHERA PHARMACEUTICALS (SCHWEIZ) GMBH (CH) 2007-05-03 US disclosed
US-20070099927-A1 Aminoalkyl-pyrazinones and-pyridones as thrombin inhibitors SANTHERA PHARMACEUTICALS (SCHWEIZ) GMBH (CH) 2007-05-03 US disclosed
US-20070099927-A1 Aminoalkyl-pyrazinones and-pyridones as thrombin inhibitors SANTHERA PHARMACEUTICALS (SCHWEIZ) GMBH (CH) 2007-05-03 US disclosed
WO-2005040137-A1 AMINOALKYL-PYRAZINONES AND -PYRIDONES AS THROMBIN INHIBITORS SANTHERA PHARMACEUTICALS (SCHWEIZ) GMBH (CH) 2005-05-06 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-20070099927-A1 Aminoalkyl-pyrazinones and-pyridones as thrombin inhibitors F2, F12, SERPINC1 ATM 1490/4885PDE8B 2477/4885ALOX5AP 1117/4885

“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.