SCHEMBL7028532

SCHEMBL7028532

COc1ccc(CCN=C(NC#N)N2CC3CC(CN(CC(O)COc4ccc(C#N)cc4)C3)C2)cc1OC

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.39
KMT2A Q03164 3/20 0.38
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
P2RX7 Q99572 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
MEN1 O00255 2/20 0.36
MCHR1 Q99705 1/20 0.36

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
SCHEMBL7034148 0.86 KCNH2 (0.40) KCNH2KMT2AKDM4EALDH1A1L3MBTL1
SCHEMBL7028528 0.86 KMT2A (0.42) KCNH2KMT2AALDH1A1
SCHEMBL7028529 0.86 KMT2A (0.42) KCNH2KMT2AALDH1A1
SCHEMBL7033247 0.85 KCNH2 (0.44) KCNH2KMT2AKDM4EALDH1A1L3MBTL1
SCHEMBL7028336 0.84 KCNH2 (0.47) KCNH2KMT2AKDM4EALDH1A1L3MBTL1
SCHEMBL7034946 0.84 KDM4E (0.44) KCNH2KMT2AKDM4EALDH1A1L3MBTL1
SCHEMBL6994695 0.83 KCNH2 (0.38) KCNH2KMT2AKDM4EALDH1A1L3MBTL1
SCHEMBL6742864 0.82 KCNH2 (0.44) KCNH2KMT2AALDH1A1MEN1MCHR1
SCHEMBL6622817 0.82 LMNA (0.44) KCNH2KMT2AKDM4EALDH1A1L3MBTL1
SCHEMBL7036600 0.81 KCNH2 (0.37) KCNH2KMT2AKDM4EALDH1A1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030212095-A1 New bispidine compounds and their use in the treatment of cardiac arrhythmias ASTRAZENECA AB (SE) 2003-11-13 US 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-20030212095-A1 New bispidine compounds and their use in the treatment of cardiac arrhythmias KCNH1, LBR, CACNA1E KCNH2 7/4885KMT2A 2608/4885KDM4E 4058/4885

“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.