SCHEMBL6929871

SCHEMBL6929871

O=C1CCC2=C1C(c1ccc(Cl)c(Cl)c1)C1=C(CCC1=O)N2

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ABCC9 O60706 19/20 0.62
KCNJ11 Q14654 19/20 0.62
ABCC8 Q09428 17/20 0.62
KCNJ8 Q15842 17/20 0.62
KDM4E B2RXH2 1/20 0.45
GAA P10253 1/20 0.45
HSD17B10 Q99714 1/20 0.45

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
SCHEMBL1002731 0.91 ABCC9 (0.73) ABCC9KCNJ11ABCC8KCNJ8KDM4E
SCHEMBL7097781 0.89 ABCC9 (0.66) ABCC9KCNJ11ABCC8KCNJ8
SCHEMBL7196992 0.88 ABCC9 (0.67) ABCC9KCNJ11ABCC8KCNJ8
SCHEMBL7095966 0.88 ABCC9 (0.67) ABCC9KCNJ11ABCC8KCNJ8
SCHEMBL6928469 0.87 ABCC9 (0.64) ABCC9KCNJ11ABCC8KCNJ8
SCHEMBL6432162 0.86 ABCC9 (0.52) ABCC9KCNJ11ABCC8KCNJ8
SCHEMBL6434268 0.84 ABCC9 (0.55) ABCC9KCNJ11ABCC8KCNJ8KDM4E
SCHEMBL6928832 0.82 ABCC9 (0.54) ABCC9KCNJ11ABCC8KCNJ8KDM4E
SCHEMBL6910255 0.81 ABCC9 (0.47) ABCC9KCNJ11ABCC8KCNJ8KDM4E
SCHEMBL5075085 0.81 ABCC9 (0.69) ABCC9KCNJ11ABCC8KCNJ8

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
JP-2003517454-A 2003-05-27 JP claimed
US-6518279-B2 For treatment of asthma, epilepsy, hypertension, impotence, migraine, pain, urinary incontinence, stroke, Raynaud's syndrome, eating disorders, functional bowel disorders, and neurodegeneration; inotropic agents ABBOTT LABORATORIES 2003-02-11 US claimed
US-20020007065-A1 CYCLOPENTANONE DIHYDROPYRIDINE COMPOUNDS USEFUL AS POTASSIUM CHANNEL OPENERS ABBOTT LABORATORIES 2002-01-17 US claimed
EP-1075466-A1 CYCLOPENTANONE DIHYDROPYRIDINE COMPOUNDS USEFUL AS POTASSIUM CHANNEL OPENERS Abbott Laboratories (US) 2001-02-14 EP claimed
WO-2000051986-A1 CYCLOPENTANONE DIHYDROPYRIDINE COMPOUNDS USEFUL AS POTASSIUM CHANNEL OPENERS ABBOTT LABORATORIES (US) 2000-09-08 WO claimed
US-6518279-B2 For treatment of asthma, epilepsy, hypertension, impotence, migraine, pain, urinary incontinence, stroke, Raynaud's syndrome, eating disorders, functional bowel disorders, and neurodegeneration; inotropic agents ABBOTT LABORATORIES 2003-02-11 US disclosed
US-20020007065-A1 CYCLOPENTANONE DIHYDROPYRIDINE COMPOUNDS USEFUL AS POTASSIUM CHANNEL OPENERS ABBOTT LABORATORIES 2002-01-17 US disclosed
EP-1075466-A1 CYCLOPENTANONE DIHYDROPYRIDINE COMPOUNDS USEFUL AS POTASSIUM CHANNEL OPENERS Abbott Laboratories (US) 2001-02-14 EP disclosed
WO-2000051986-A1 CYCLOPENTANONE DIHYDROPYRIDINE COMPOUNDS USEFUL AS POTASSIUM CHANNEL OPENERS ABBOTT LABORATORIES (US) 2000-09-08 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-20020007065-A1 CYCLOPENTANONE DIHYDROPYRIDINE COMPOUNDS USEFUL AS POTASSIUM CHANNEL OPENERS KCNN1, KCNJ2, KCNH1 ABCC9 416/4885KCNJ11 4/4885ABCC8 743/4885

“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.