SCHEMBL2632639

SCHEMBL2632639

COc1ccc(CCOC2CCCC[C@H]2N2CC[C@@H](OC(C)=O)C2)cc1OC

nearest known ligand 0.72

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SLC6A4 P31645 1/20 0.72
▸ KCNA5 P22460 6/20 0.71
▸ SCN5A Q14524 6/20 0.71
▸ KCND2 Q9NZV8 5/20 0.71
▸ KCNH2 Q12809 1/20 0.71
▸ CHRM5 P08912 3/20 0.44
▸ CHRM1 P11229 3/20 0.44
▸ CHRM3 P20309 3/20 0.44
▸ ALDH1A1 P00352 3/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ KMT2A Q03164 4/20 0.43
▸ POLB P06746 1/20 0.41
▸ RECQL P46063 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ MEN1 O00255 3/20 0.41
▸ EPHX1 P07099 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.40

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
SCHEMBL942130 1.00 SLC6A4 (0.72) SLC6A4KCNA5SCN5AKCND2KCNH2
SCHEMBL14459896 1.00 SLC6A4 (0.72) SLC6A4KCNA5SCN5AKCND2KCNH2
SCHEMBL2624897 1.00 SLC6A4 (0.72) SLC6A4KCNA5SCN5AKCND2KCNH2
Hydrochloric Acid SCHEMBL1419021 0.99 KCNA5 (0.72) SLC6A4KCNA5SCN5AKCND2KCNH2
Hydrochloric Acid SCHEMBL1016912 0.99 KCNA5 (0.72) SLC6A4KCNA5SCN5AKCND2KCNH2
Hydrochloric Acid SCHEMBL1016965 0.99 KCNA5 (0.72) SLC6A4KCNA5SCN5AKCND2KCNH2
Hydrochloric Acid SCHEMBL941452 0.99 KCNA5 (0.72) SLC6A4KCNA5SCN5AKCND2KCNH2
Hydrochloric Acid SCHEMBL5523721 0.99 KCNA5 (0.72) SLC6A4KCNA5SCN5AKCND2KCNH2
SCHEMBL12295985 0.95 SLC6A4 (0.66) SLC6A4KCNA5SCN5AKCND2KCNH2
SCHEMBL13198873 0.93 SLC6A4 (0.62) SLC6A4KCNA5SCN5AKCND2KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120095073-A1 ION CHANNEL MODULATING ACTIVITY II CARDIOME PHARMA CORP. (CA) 2012-04-19 — — US disclosed
EP-1666459-B1 Aminocyclohexyl ether compounds and uses thereof CARDIOME PHARMA CORP (CA) 2011-10-19 — — EP disclosed
US-20110118329-A1 USES OF ION CHANNEL MODULATING COMPOUNDS CARDIOME PHARMA CORP. (CA) 2011-05-19 — — US disclosed
US-7820712-B2 Uses of ion channel modulating compounds CARDIOME PHARMA CORP. (CA) 2010-10-26 — — US disclosed
US-20090270478-A1 ION CHANNEL MODULATING ACTIVITY II CARDIOME PHARMA CORP. (CA) 2009-10-29 — — US disclosed
US-7507545-B2 Ion channel modulating activity method CARDIOME PHARMA CORP. (CA) 2009-03-24 — — US disclosed
US-20080188547-A1 USES OF ION CHANNEL MODULATING COMPOUNDS CARDIOME PHARMA CORP. (CA) 2008-08-07 — — US disclosed
US-7345086-B2 Uses of ion channel modulating compounds CARDIOME PHARMA CORP. (CA) 2008-03-18 — — US disclosed
US-20070254945-A1 AMINOCYCLOHEXYL ETHER COMPOUNDS AND USES THEREOF CARDIOME PHARMA CORP. (CA) 2007-11-01 — — 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 (5 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-20070254945-A1 AMINOCYCLOHEXYL ETHER COMPOUNDS AND USES THEREOF KCNH2, KCNC1, KCNH3 SLC6A4 1837/4885KCNA5 16/4885SCN5A 24/4885
US-20090270478-A1 ION CHANNEL MODULATING ACTIVITY II KCNH1, KCNN3, KCNN2 SLC6A4 511/4885KCNA5 31/4885SCN5A 59/4885
US-20110118329-A1 USES OF ION CHANNEL MODULATING COMPOUNDS KCNN1, KCNN2, KCNN3 SLC6A4 296/4885KCNA5 48/4885SCN5A 49/4885
US-20080188547-A1 USES OF ION CHANNEL MODULATING COMPOUNDS KCNN1, KCNN2, KCNN3 SLC6A4 296/4885KCNA5 48/4885SCN5A 49/4885
US-20120095073-A1 ION CHANNEL MODULATING ACTIVITY II KCNH1, KCNN3, KCNJ2 SLC6A4 493/4885KCNA5 34/4885SCN5A 64/4885

“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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