SCHEMBL6790706

SCHEMBL6790706

CCCCOc1ccc(N(C)C(=O)C(O)C2(O)CCN(CCc3ccccc3)CC2)cc1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.43
OPRM1 P35372 6/20 0.43
OPRD1 P41143 3/20 0.43
OPRK1 P41145 2/20 0.43
MMP1 P03956 3/20 0.42
MMP9 P14780 3/20 0.42
MMP13 P45452 3/20 0.42
ADAM17 P78536 3/20 0.42
KCNH2 Q12809 1/20 0.42

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
SCHEMBL6785641 0.91 MMP9 (0.44) THRBOPRM1OPRD1OPRK1MMP1
SCHEMBL6783449 0.85 KCNH2 (0.43) THRBOPRM1OPRD1OPRK1MMP1
Hydrochloric Acid SCHEMBL6785113 0.84 KCNH2 (0.45) THRBOPRM1OPRD1OPRK1MMP1
SCHEMBL6905985 0.80 MMP9 (0.43) THRBOPRM1OPRD1OPRK1MMP1
SCHEMBL6780276 0.80 KCNH2 (0.43) THRBOPRM1OPRD1OPRK1MMP1
Hydrochloric Acid SCHEMBL6779775 0.80 KCNH2 (0.44) THRBOPRM1OPRD1OPRK1KCNH2
SCHEMBL6895994 0.78 MMP1 (0.49) MMP1MMP9MMP13ADAM17
SCHEMBL6783010 0.78 MEN1 (0.40)
SCHEMBL6783537 0.77 KCNH2 (0.45) THRBOPRM1OPRD1OPRK1MMP1
Hydrochloric Acid SCHEMBL6784418 0.76 KCNH2 (0.47) THRBOPRM1OPRD1OPRK1KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6710060-B2 4-hydroxypiperidine derivatives having antiarrhythmic activity MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2004-03-23 US disclosed
US-20020188006-A1 4-hydroxypiperidine derivatives having antiarrhythmic activity MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2002-12-12 US disclosed
EP-1182192-A1 4-HYDROXYPIPERIDINE DERIVATIVES HAVING ANTIARRHYTHMIC EFFECT MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2002-02-27 EP 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-20020188006-A1 4-hydroxypiperidine derivatives having antiarrhythmic activity SCN5A, RYR2, SCN1B THRB 825/4885OPRM1 366/4885OPRD1 207/4885

“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.