SCHEMBL4680123

SCHEMBL4680123

CC(C)(C)CC(NC(=O)c1ccc(C(F)(F)F)cc1)NC(=NS(=O)(=O)C(F)(F)F)Nc1cccnc1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.49
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
NAMPT P43490 6/20 0.44
ABCC9 O60706 9/20 0.44
KCNJ11 Q14654 9/20 0.44
ABCC8 Q09428 6/20 0.44
KCNJ8 Q15842 6/20 0.44
SLC2A1 P11166 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL4680119 1.00 EPHX2 (0.49) EPHX2NPC1RAB9ANAMPTABCC9
SCHEMBL4679999 0.92 ABCC9 (0.51) NPC1RAB9ANAMPTABCC9KCNJ11
SCHEMBL4679689 0.92 ABCC9 (0.54) NAMPTABCC9KCNJ11ABCC8KCNJ8
SCHEMBL4680001 0.92 ABCC9 (0.51) NPC1RAB9ANAMPTABCC9KCNJ11
SCHEMBL4679690 0.92 ABCC9 (0.54) NAMPTABCC9KCNJ11ABCC8KCNJ8
SCHEMBL4680241 0.86 EPHX2 (0.49) EPHX2NPC1RAB9ANAMPTABCC9
SCHEMBL4680237 0.86 EPHX2 (0.49) EPHX2NPC1RAB9ANAMPTABCC9
SCHEMBL4682636 0.81 ABCC9 (0.55) NAMPTABCC9KCNJ11ABCC8KCNJ8
SCHEMBL4682639 0.81 ABCC9 (0.55) NAMPTABCC9KCNJ11ABCC8KCNJ8
SCHEMBL4678649 0.80 ABCC9 (0.54) NAMPTABCC9KCNJ11ABCC8KCNJ8

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 claimed
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 claimed
US-20020028836-A1 Potassium channel openers ABBVIE INC. 2002-03-07 US claimed
EP-1392655-B1 POTASSIUM CHANNEL OPENERS ABBOTT LAB (US) 2008-07-16 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
US-20020028836-A1 Potassium channel openers ABBVIE INC. 2002-03-07 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 (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 EPHX2 3632/4885NPC1 220/4885RAB9A 3504/4885

“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.