SCHEMBL2211571

SCHEMBL2211571

CN1CCCN(c2cncc(-c3cccc(C=CC(N)=O)c3)n2)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PIM2 Q9P1W9 17/20 1.00
PIM1 P11309 4/20 0.84
CSNK2A2 P19784 1/20 0.84
CSNK2A1 P68400 1/20 0.84
DYRK1A Q13627 1/20 0.44
RAD52 P43351 1/20 0.43
CHEK1 O14757 1/20 0.42

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
SCHEMBL2211569 1.00 PIM2 (1.00) PIM2PIM1CSNK2A2CSNK2A1DYRK1A
SCHEMBL2214184 0.91 PIM2 (1.00) PIM2PIM1CSNK2A2CSNK2A1
SCHEMBL2212990 0.91 PIM2 (1.00) PIM2PIM1CSNK2A2CSNK2A1
SCHEMBL2213763 0.89 PIM2 (0.81) PIM2PIM1CSNK2A2CSNK2A1DYRK1A
SCHEMBL12512814 0.89 PIM2 (0.81) PIM2PIM1CSNK2A2CSNK2A1DYRK1A
SCHEMBL2213768 0.89 PIM2 (0.81) PIM2PIM1CSNK2A2CSNK2A1DYRK1A
SCHEMBL12513377 0.87 PIM2 (0.78) PIM2PIM1CSNK2A2CSNK2A1DYRK1A
SCHEMBL2211724 0.87 PIM2 (1.00) PIM2PIM1CSNK2A2CSNK2A1
SCHEMBL2213833 0.87 PIM2 (1.00) PIM2PIM1CSNK2A2CSNK2A1
SCHEMBL2211564 0.86 PIM2 (0.76) PIM2PIM1CSNK2A2CSNK2A1DYRK1A

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8318723-B2 Pyrazine compounds, their use and methods of preparation BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-11-27 US claimed
EP-2061762-B1 PYRAZINE COMPOUNDS, THEIR USE AND METHODS OF PREPARATION BOEHRINGER INGELHEIM INT (DE) 2011-07-27 EP claimed
US-20100210627-A1 PYRAZINE COMPOUNDS, THEIR USE AND METHODS OF PREPARATION BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-08-19 US claimed
US-8318723-B2 Pyrazine compounds, their use and methods of preparation BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-11-27 US disclosed
EP-2061762-B1 PYRAZINE COMPOUNDS, THEIR USE AND METHODS OF PREPARATION BOEHRINGER INGELHEIM INT (DE) 2011-07-27 EP disclosed
US-20100210627-A1 PYRAZINE COMPOUNDS, THEIR USE AND METHODS OF PREPARATION BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-08-19 US disclosed
EP-2061762-A2 PYRAZINE COMPOUNDS, THEIR USE AND METHODS OF PREPARATION Boehringer Ingelheim International GmbH (DE) 2009-05-27 EP disclosed
WO-2008022164-A2 PYRAZINE COMPOUNDS, THEIR USE AND METHODS OF PREPARATION BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2008-02-21 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-20100210627-A1 PYRAZINE COMPOUNDS, THEIR USE AND METHODS OF PREPARATION CDK2, PIM1, CCNK PIM2 16/4885PIM1 2/4885CSNK2A2 90/4885

“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.