SCHEMBL5483406

SCHEMBL5483406

Cc1cnc(NCCC2CCCN2C(=O)OC(C)(C)C)c(=O)n1CCO

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 1/20 0.39
FEN1 P39748 1/20 0.39
ATM Q13315 2/20 0.38
CHEK2 O96017 1/20 0.38
F2 P00734 4/20 0.36
PRMT5 O14744 1/20 0.35
LMNA P02545 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
TRPV1 Q8NER1 1/20 0.35
ALDH1A1 P00352 1/20 0.35
OPRD1 P41143 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
IRAK4 Q9NWZ3 1/20 0.34
SYK P43405 1/20 0.34

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 0.97 ATM (0.39) ALOX5APFEN1ATMCHEK2F2
SCHEMBL5483612 0.88 ATM (0.39) ALOX5APFEN1ATMCHEK2PRMT5
SCHEMBL5479364 0.87 CHEK2 (0.39) ALOX5APFEN1ATMCHEK2F2
SCHEMBL5471641 0.87 ATM (0.38) ALOX5APFEN1ATMCHEK2F2
SCHEMBL5479621 0.84 ATM (0.39) ALOX5APFEN1ATMCHEK2F2
SCHEMBL8293870 0.80 ATM (0.40) ALOX5APFEN1ATMCHEK2F2
SCHEMBL7023932 0.80 PRMT5 (0.42) ALOX5APFEN1F2PRMT5LMNA
SCHEMBL7022729 0.80 PRMT5 (0.42) ALOX5APFEN1F2PRMT5LMNA
SCHEMBL7023114 0.80 PRMT5 (0.42) ALOX5APFEN1F2PRMT5LMNA
SCHEMBL5475019 0.78 ATM (0.37) ALOX5APFEN1ATMCHEK2PRMT5

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 ALOX5AP 1117/4885FEN1 1345/4885ATM 1490/4885

“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.