SCHEMBL4684065

SCHEMBL4684065

Cc1ccc(C(=O)NC(Cc2ccccc2)C(N)=O)cc1

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 11/20 0.65
CA1 P00915 2/20 0.62
CA12 O43570 1/20 0.62
CA9 Q16790 1/20 0.62
CA2 P00918 2/20 0.56
PTPN1 P18031 1/20 0.56
NPC1 O15118 1/20 0.55
RAB9A P51151 1/20 0.55
CTSL P07711 2/20 0.54
CTSS P25774 2/20 0.54
CTSK P43235 2/20 0.54
CTSB P07858 1/20 0.54

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
SCHEMBL15096029 0.91 PTPN1 (0.58) HPGDSCA1CA2PTPN1NPC1
SCHEMBL20277616 0.90 HPGDS (0.71) HPGDSCA1CA12CA9CA2
SCHEMBL17244326 0.90 HPGDS (0.71) HPGDSCA1CA12CA9CA2
SCHEMBL10526607 0.88 PTPN1 (0.70) CA1CA12CA9CA2PTPN1
SCHEMBL4166657 0.88 PTPN1 (0.70) CA1CA12CA9CA2PTPN1
SCHEMBL4682004 0.88 PTPN1 (0.70) CA1CA12CA9CA2PTPN1
SCHEMBL2105972 0.86 HPGDS (0.65) HPGDSCA1CA12CA9CA2
SCHEMBL27002688 0.86 HPGDS (0.65) HPGDSCA1CA12CA9CA2
SCHEMBL27695921 0.86 HPGDS (0.65) HPGDSCA1CA12CA9CA2
SCHEMBL9180103 0.85 HPGDS (0.61) HPGDSCA1CA12CA9CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1392655-B1 POTASSIUM CHANNEL OPENERS ABBOTT LAB (US) 2008-07-16 EP disclosed
EP-1198456-B1 POTASSIUM CHANNEL OPENERS ABBOTT LAB (US) 2007-09-19 EP disclosed
EP-1392655-A2 POTASSIUM CHANNEL OPENERS Abbott Laboratories (US) 2004-03-03 EP disclosed
US-6645968-B2 E.g., N-(1-((anilinocarbonyl)amino)-2,2,2-trichloroethyl)-4-methyl-benzamide; antiepileptic, -ischemic and cardiotonic agents; sexual, eating and urogenital disorders; asthma; migraines; ABBOTT LABORATORIES 2003-11-11 US disclosed
WO-2002062762-A2 POTASSIUM CHANNEL OPENERS ABBOTT LABORATORIES (US) 2002-08-15 WO disclosed
EP-1198456-A2 POTASSIUM CHANNEL OPENERS Abbott Laboratories (US) 2002-04-24 EP disclosed
US-20020028836-A1 Potassium channel openers ABBVIE INC. 2002-03-07 US disclosed
WO-2001009096-A2 POTASSIUM CHANNEL OPENERS ABBOTT LABORATORIES (US) 2001-02-08 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-20020028836-A1 Potassium channel openers KCNJ2, KCNJ11, KCNJ1 HPGDS 1859/4885CA1 667/4885CA12 4121/4885

“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.