SCHEMBL6737207

SCHEMBL6737207

CN(C)/C=C(/C(=O)c1ccc(C#N)cc1)c1ccc(C#N)cc1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CYP11B1 P15538 9/20 0.53
▸ CYP11B2 P19099 6/20 0.53
▸ CA1 P00915 2/20 0.46
▸ CA2 P00918 2/20 0.46
▸ GSK3B P49841 2/20 0.42
▸ FNTA P49354 1/20 0.41
▸ FNTB P49356 1/20 0.41
▸ NSD2 O96028 1/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ PKM P14618 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ ATM Q13315 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ RAB9A P51151 1/20 0.39

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
SCHEMBL6737213 1.00 CYP11B1 (0.53) CYP11B1CYP11B2CA1CA2GSK3B
SCHEMBL7479989 0.88 CYP11B1 (0.47) CYP11B1CYP11B2CA1CA2GSK3B
SCHEMBL11009980 0.87 CYP11B1 (0.47) CYP11B1CYP11B2CA1CA2GSK3B
SCHEMBL23832223 0.87 CYP11B1 (0.47) CYP11B1CYP11B2CA1CA2GSK3B
SCHEMBL11013190 0.87 CYP11B1 (0.47) CYP11B1CYP11B2CA1CA2GSK3B
Dimethylformamide SCHEMBL7479987 0.85 CYP11B1 (0.46) CYP11B1CYP11B2CA1CA2GSK3B
SCHEMBL23839943 0.83 CYP11B1 (0.48) CYP11B1CYP11B2CA1CA2GSK3B
SCHEMBL9476052 0.81 CYP11B1 (0.51) CYP11B1CYP11B2CA1CA2GSK3B
SCHEMBL5098916 0.80 CYP11B1 (0.43) CYP11B1CYP11B2CA1CA2FNTA
SCHEMBL5098910 0.80 CYP11B1 (0.43) CYP11B1CYP11B2CA1CA2FNTA

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-20040229900-A1 Bispidine compounds useful in the treatment of cardiac arrythmias ASTRAZENECA AB (SE) 2004-11-18 — — US disclosed
CN-1370167-A Novel bridged bispidine compounds for the treatment of cardiac arrhythmias ASTRAZENECA AB (SE) 2002-09-18 — — CN disclosed
EP-1192157-A1 BISPIDINE COMPOUNDS USEFUL IN THE TREATMENT OF CARDIAC ARRHYTHMIAS AstraZeneca AB (SE) 2002-04-03 — — EP disclosed
WO-2000077000-A1 NEW BISPIDINE COMPOUNDS USEFUL IN THE TREATMENT OF CARDIAC ARRHYTHMIAS ASTRAZENECA AB (SE) 2000-12-21 — — 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-20040229900-A1 Bispidine compounds useful in the treatment of cardiac arrythmias ADRA1B, ADRB2, ADRA1D CYP11B1 281/4885CYP11B2 253/4885CA1 4299/4885

“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.

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