SCHEMBL7034656

SCHEMBL7034656

CNC(=O)NC(COc1ccc(C#N)cc1)CN1CC2CC(CN(CCc3ccc(OC)c(OC)c3)C2)C1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 14/20 0.47
KCNH2 Q12809 4/20 0.39
MMP2 P08253 1/20 0.38
ANPEP P15144 1/20 0.38
POLB P06746 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
DPP4 P27487 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
SCHEMBL7028336 0.84 KCNH2 (0.47) MCHR1KCNH2
SCHEMBL7034662 0.82 KCNH2 (0.42) KCNH2MMP2
SCHEMBL6987304 0.82 MCHR1 (0.46) MCHR1KCNH2MMP2ANPEP
SCHEMBL7036599 0.80 SIGMAR1 (0.43) KCNH2MMP2
SCHEMBL7030390 0.80 KCNH2 (0.43) KCNH2MMP2POLB
SCHEMBL7027091 0.79 MCHR1 (0.49) MCHR1KCNH2
SCHEMBL7030606 0.79 KCNH2 (0.42) KCNH2MMP2
SCHEMBL7033619 0.79 KCNH2 (0.39) KCNH2MMP2
SCHEMBL7034139 0.78 EPHX2 (0.45) KCNH2
SCHEMBL6742864 0.78 KCNH2 (0.44) MCHR1KCNH2POLBSMN1; SMN2

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 MCHR1 1346/4885KCNH2 7/4885MMP2 4267/4885

“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.