SCHEMBL5481633

SCHEMBL5481633

O=c1c(NCCc2ccccn2)ncc(Cl)n1CCO

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
F2 P00734 17/20 0.52
PRSS1 P07477 1/20 0.47
CYP1A2 P05177 1/20 0.43
FGFR1 P11362 1/20 0.43
MAOB P27338 1/20 0.43

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
SCHEMBL8292334 0.89 F2 (0.49) F2PRSS1CYP1A2FGFR1MAOB
SCHEMBL8292341 0.88 F2 (0.53) F2PRSS1
SCHEMBL5484738 0.85 F2 (0.53) F2PRSS1
SCHEMBL5477413 0.84 F2 (0.53) F2PRSS1
SCHEMBL8293018 0.84 F2 (0.54) F2PRSS1FGFR1
SCHEMBL8292340 0.84 CYP1A2 (0.53) F2PRSS1CYP1A2FGFR1
SCHEMBL8292349 0.83 F2 (0.51) F2PRSS1
SCHEMBL5474701 0.82 F2 (0.49) F2PRSS1FGFR1
SCHEMBL5475034 0.82 F2 (0.47) F2PRSS1FGFR1MAOB
SCHEMBL8292336 0.82 F2 (0.49) F2PRSS1

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 6 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
WO-2005040137-A1 AMINOALKYL-PYRAZINONES AND -PYRIDONES AS THROMBIN INHIBITORS SANTHERA PHARMACEUTICALS (SCHWEIZ) GMBH (CH) 2005-05-06 WO disclosed
EP-1526131-A1 Aminoalkyl-pyrazinones and -pyridones as thrombin inhibitors Graffinity Pharmaceuticals Aktiengesellschaft (DE) 2005-04-27 EP 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 F2 1/4885PRSS1 67/4885CYP1A2 105/4885

“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.