SCHEMBL7245692

SCHEMBL7245692

CC#CCOC(=O)N(C)C1C2CCC1CN(CC(O)COc1ccc(C#N)cc1)C2

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.45
ALDH1A1 P00352 3/20 0.43
KDM4E B2RXH2 3/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
POLB P06746 2/20 0.42
HPGD P15428 2/20 0.41
MAPK1 P28482 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
MAPT P10636 1/20 0.39
GRIN1 Q05586 2/20 0.38
GRIN2B Q13224 2/20 0.38
HSD17B10 Q99714 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
HRH1 P35367 1/20 0.38
CCR3 P51677 1/20 0.38

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
SCHEMBL7251037 0.86 KCNH2 (0.45) KCNH2ALDH1A1KDM4EMEN1KMT2A
SCHEMBL7252026 0.86 HRH2 (0.41) GRIN1GRIN2BHRH1
SCHEMBL7244717 0.85 MEN1 (0.51) KCNH2ALDH1A1KDM4EMEN1KMT2A
SCHEMBL7246413 0.84 MEN1 (0.47) KCNH2ALDH1A1KDM4EMEN1KMT2A
SCHEMBL7242512 0.83 KCNH2 (0.51) KCNH2ALDH1A1KDM4EMEN1KMT2A
SCHEMBL7249996 0.83 KCNH2 (0.46) KCNH2ALDH1A1KDM4EMEN1KMT2A
SCHEMBL6096348 0.82 KCNH2 (0.48) KCNH2ALDH1A1KDM4EMEN1KMT2A
SCHEMBL7247034 0.81 KCNH2 (0.47) KCNH2ALDH1A1KDM4EMEN1KMT2A
SCHEMBL7245879 0.81 KCNH2 (0.47) KCNH2ALDH1A1KDM4EMEN1KMT2A
SCHEMBL7245522 0.81 KCNH2 (0.49) KCNH2ALDH1A1KDM4EMEN1KMT2A

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-6559162-B2 Electrophysiological activity ASTRAZENECA AB (SE) 2003-05-06 US disclosed
EP-1244631-A1 NEW AZABICYCLOOCTANE DERIVATIVES USEFUL IN THE TREATMENT OF CARDIAC ARRHYTHMIAS AstraZeneca AB (SE) 2002-10-02 EP disclosed
US-20020137766-A1 Azabicyclooctane derivatives useful in the treatment of cardiac arrhythmias ASTRAZENECA AB (SE) 2002-09-26 US disclosed
WO-2001047893-A1 NEW AZABICYCLOOCTANE DERIVATIVES USEFUL IN THE TREATMENT OF CARDIAC ARRHYTHMIAS ASTRAZENECA AB (SE) 2001-07-05 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-20020137766-A1 Azabicyclooctane derivatives useful in the treatment of cardiac arrhythmias KCNH1, KCNH2, KCNH3 KCNH2 2/4885ALDH1A1 315/4885KDM4E 3182/4885

“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.