SCHEMBL2966852

SCHEMBL2966852

CC(C)(C)C(=O)CN1CC2CN(CCCNc3ccc(C#N)cc3)CC(C1)O2

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 2/20 0.44
CCR3 P51677 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 1/20 0.37
AR P10275 3/20 0.35
HRH2 P25021 2/20 0.35
HRH1 P35367 2/20 0.35
KCNA5 P22460 2/20 0.34
EGLN2 Q96KS0 1/20 0.34
RORC P51449 2/20 0.34
CYP2D6 P10635 1/20 0.33
OPRK1 P41145 1/20 0.33
FPR2 P25090 1/20 0.33
DRD2 P14416 1/20 0.33
DRD3 P35462 1/20 0.33

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
SCHEMBL6094385 0.91 CCR3 (0.40) CCR3MEN1KMT2AARHRH2
SCHEMBL6986200 0.89 CCR3 (0.39) CCR3MEN1KMT2AARHRH2
SCHEMBL2966214 0.89 KCNH2 (0.44) KCNH2CCR3MEN1KMT2AHRH2
SCHEMBL2967483 0.86 KCNH2 (0.48) KCNH2CCR3MEN1KMT2AHRH2
SCHEMBL2956478 0.84 KDM4E (0.38) MEN1KMT2AAR
SCHEMBL3126044 0.84 KCNH2 (0.45) KCNH2CCR3RORCFPR2DRD2
SCHEMBL2958763 0.84 KCNH2 (0.44) KCNH2CCR3MEN1KMT2AHRH2
SCHEMBL2967583 0.84 KCNH2 (0.45) KCNH2CCR3MEN1KMT2AHRH2
SCHEMBL2970015 0.84 KCNH2 (0.45) KCNH2CCR3MEN1KMT2AAR
SCHEMBL5965408 0.84 AR (0.41) CCR3MEN1ARHRH2HRH1

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 100 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090036675-A1 New process for production of oxabispidines ASTRAZENECA AB (SE) 2009-02-05 US claimed
EP-1900741-A1 New process for the production of oxabispidines AstraZeneca AB (SE) 2008-03-19 EP claimed
US-7217708-B2 Cardiovascular disorders ASTRAZENECA AB (SE) 2007-05-15 US claimed
EP-1389212-B1 3,7-DIAZABICYCLO 3.3.1| FORMULATIONS AS ANTI-ARRYTHMIC COMPOUNDS ASTRAZENECA AB (SE) 2006-07-12 EP claimed
EP-1389213-B1 3,7-DIAZABICYCLO 3.3.1| FORMULATIONS AS ANTIARHYTHMIC COMPOUNDS ASTRAZENECA AB (SE) 2006-04-12 EP claimed
EP-1401502-B1 PHARMACEUTICAL FORMULATION COMPRISING IOTA-CARRAGEENAN AND AT LEAST ONE NEUTRAL GELLING POLYMER ASTRAZENECA AB (SE) 2005-12-28 EP claimed
EP-1559717-A2 Oxabispidine compounds useful in the treatment of cardiac arrythmias AstraZeneca AB (SE) 2005-08-03 EP claimed
EP-1550663-A1 New crystalline forms of antiarrhythmic compounds Astra Zeneca AB (SE) 2005-07-06 EP claimed
EP-1235831-B1 NEW OXABISPIDINE COMPOUNDS USEFUL IN THE TREATMENT OF CARDIAC ARRHYTHMIAS ASTRAZENECA AB (SE) 2005-03-30 EP claimed
US-20050037067-A1 3,7-Diazabicyclo [3.3.1]formulations as anti-arrhythmic compounds ASTRAZENECA AB (SE) 2005-02-17 US claimed
EP-1389212-A1 3,7-DIAZABICYCLO 3.3.1] FORMULATIONS AS ANTI-ARRYTHMIC COMPOUNDS AstraZeneca AB (SE) 2004-02-18 EP claimed
EP-1389211-A1 3,7-DIAZYBICYCLO 3.3.1] FORMULATIONS AS ANTIARRHYTMIC COMPOUNDS AstraZeneca AB (SE) 2004-02-18 EP claimed
US-20030153564-A1 New oxabispidine compounds useful in the treatment of cardiac arrhythmias ASTRAZENECA AB 2003-08-14 US claimed
EP-1330461-A1 NEW OXABISPIDINE COMPOUND USEFUL IN THE TREATMENT OF CARDIAC ARRHYTHMIAS AstraZeneca AB (SE) 2003-07-30 EP claimed
US-6559143-B1 Class III electrophysiological activity, drugs which prolong the trans-membrane action potential duration and refractoriness, without affecting cardiac conduction ASTRAZENECA AB (SE) 2003-05-06 US claimed
WO-2003000293-A1 PHARMACEUTICAL FORMULATION ASTRAZENECA AB (SE) 2003-01-03 WO claimed
WO-2002083687-A1 3,7-DIAZYBICYCLO [3.3.1] FORMULATIONS AS ANTIARRHYTMIC COMPOUNDS ASTRAZENECA AB (SE) 2002-10-24 WO claimed
WO-2002083688-A1 3,7-DIAZABICYCLO [3.3.1] FORMULATIONS AS ANTIARHYTHMIC COMPOUNDS ASTRAZENECA AB (SE) 2002-10-24 WO claimed
WO-2002083689-A1 3,7-DIAZABICYCLO [3.3.1] FORMULATIONS AS ANTI-ARRYTHMIC COMPOUNDS ASTRAZENECA AB (SE) 2002-10-24 WO claimed
WO-2002028863-A1 NEW OXABISPIDINE COMPOUND USEFUL IN THE TREATMENT OF CARDIAC ARRHYTHMIAS ASTRAZENECA AB (SE) 2002-04-11 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 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-20030153564-A1 New oxabispidine compounds useful in the treatment of cardiac arrhythmias KCNH1, CACNA1E, RYR1 KCNH2 9/4885CCR3 3660/4885MEN1 2766/4885
US-20050037067-A1 3,7-Diazabicyclo [3.3.1]formulations as anti-arrhythmic compounds CACNA1G, CACNA1I, CACNA1B KCNH2 29/4885CCR3 2086/4885MEN1 4114/4885
US-20090036675-A1 New process for production of oxabispidines AVPR1B, CCNB1, DHPS KCNH2 424/4885CCR3 3095/4885MEN1 2977/4885

“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.