SCHEMBL6989329

SCHEMBL6989329

CC(C)(C)C(NC(=O)c1ccc(Cl)cc1)Nc1c(Nc2ccccn2)c(=O)c1=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.50
PLK1 P53350 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
ABCC9 O60706 1/20 0.45
ABCC8 Q09428 1/20 0.45
KCNJ11 Q14654 1/20 0.45
KCNJ8 Q15842 1/20 0.45
NPC1 O15118 7/20 0.43
RAB9A P51151 6/20 0.43
TLR7 Q9NYK1 1/20 0.42
AGTR1 P30556 1/20 0.42
OPRK1 P41145 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
FFAR2 O15552 1/20 0.42
TP53 P04637 1/20 0.41
MAPT P10636 1/20 0.41
CASP1 P29466 1/20 0.41
S1PR3 Q99500 2/20 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
SCHEMBL6986808 0.84 RAB9A (0.51) LMNAPLK1SMN1; SMN2MEN1KMT2A
SCHEMBL6989221 0.83 KCNJ11 (0.45) LMNAPLK1SMN1; SMN2MEN1KMT2A
SCHEMBL6991098 0.82 PLK1 (0.54) PLK1KMT2AABCC9ABCC8KCNJ11
SCHEMBL6989346 0.81 KCNJ11 (0.50) LMNAMEN1KMT2AABCC9ABCC8
SCHEMBL6981921 0.80 ABCC9 (0.64) LMNASMN1; SMN2MEN1KMT2AABCC9
SCHEMBL6988322 0.79 KCNQ3 (0.50) PLK1ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL6989878 0.78 MAPT (0.50) PLK1SMN1; SMN2MEN1KMT2AABCC9
SCHEMBL6987283 0.77 KMT2A (0.44) MEN1KMT2AABCC9ABCC8KCNJ11
SCHEMBL6983908 0.76 ABCC9 (0.44) PLK1SMN1; SMN2MEN1KMT2AABCC9
SCHEMBL7559791 0.76 POLB (0.42) LMNASMN1; SMN2MEN1KMT2AABCC9

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-1358160-A1 AMINAL DIONES AS POTASSIUM CHANNEL OPENERS Abbott Laboratories (US) 2003-11-05 EP claimed
US-6495576-B2 N-(1-((3,4-DIOXO-2-(3-PYRIDINYLAMINO)-1-CYCLOBUTEN-1-YL)AMINO) -2,2-DIMETHYLPROPYL)-4-METHYLBENZAMIDE FOR EXAMPLE; TREATING BLADDER OVERACTIVITY, BENIGN PROSTATIC HYPERPLASIA, PREMATURE LABOR, AND SEXUAL DISORDERS ABBOTT LABORATORIES 2002-12-17 US claimed
US-20020165264-A1 Aminal diones as potassium channel openers ABBOTT LABORATORIES 2002-11-07 US claimed
WO-2002062761-A1 AMINAL DIONES AS POTASSIUM CHANNEL OPENERS ABBOTT LABORATORIES (US) 2002-08-15 WO claimed
EP-1358160-A1 AMINAL DIONES AS POTASSIUM CHANNEL OPENERS Abbott Laboratories (US) 2003-11-05 EP disclosed
US-6495576-B2 N-(1-((3,4-DIOXO-2-(3-PYRIDINYLAMINO)-1-CYCLOBUTEN-1-YL)AMINO) -2,2-DIMETHYLPROPYL)-4-METHYLBENZAMIDE FOR EXAMPLE; TREATING BLADDER OVERACTIVITY, BENIGN PROSTATIC HYPERPLASIA, PREMATURE LABOR, AND SEXUAL DISORDERS ABBOTT LABORATORIES 2002-12-17 US disclosed
US-20020165264-A1 Aminal diones as potassium channel openers ABBOTT LABORATORIES 2002-11-07 US disclosed
WO-2002062761-A1 AMINAL DIONES AS POTASSIUM CHANNEL OPENERS ABBOTT LABORATORIES (US) 2002-08-15 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-20020165264-A1 Aminal diones as potassium channel openers KCNJ2, KCNJ11, KCNH1 LMNA 605/4885PLK1 3535/4885SMN1; SMN2 557/4885

“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.