SCHEMBL5479136

SCHEMBL5479136

CN1CCCCC1CCNc1ncc(Cl)n(CCO)c1=O

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CAMK2D Q13557 1/20 0.37
F2 P00734 2/20 0.36
RAD52 P43351 2/20 0.36
TERT O14746 1/20 0.35
KAT2B Q92831 1/20 0.35
ACKR3 P25106 2/20 0.35
HRH2 P25021 1/20 0.35
HRH1 P35367 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
ERAP1 Q9NZ08 1/20 0.35
ADRA2A P08913 1/20 0.35
GFER P55789 1/20 0.35
MITF O75030 1/20 0.35
ACP1 P24666 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
SCHEMBL5476014 0.86 CHRNB2 (0.37) CAMK2DF2TERT
SCHEMBL8294507 0.85 F2 (0.40) F2TERT
SCHEMBL5475444 0.84 F2 (0.35) F2TERT
SCHEMBL5483612 0.83 ATM (0.39)
SCHEMBL5475153 0.82 F2 (0.36) F2TERT
SCHEMBL5475166 0.79 KAT2B (0.44) KAT2BNPC1RAB9AACP1
SCHEMBL5477450 0.76 F2 (0.39) F2TERTKAT2B
SCHEMBL5478507 0.75 LTA4H (0.38) F2
SCHEMBL5479579 0.74 F2 (0.34) F2
SCHEMBL8294721 0.73 F2 (0.40) CAMK2DF2TERTACKR3GFER

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 CAMK2D 2602/4885F2 1/4885RAD52 2119/4885

“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.