SCHEMBL6989346

SCHEMBL6989346

COc1ncccc1Nc1c(NC(NC(=O)c2ccc(Cl)cc2)C(C)(C)C)c(=O)c1=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNJ11 Q14654 4/20 0.50
P2RX7 Q99572 3/20 0.50
IDO1 P14902 4/20 0.44
ABCC9 O60706 2/20 0.43
ABCC8 Q09428 2/20 0.43
KCNJ8 Q15842 2/20 0.43
L3MBTL1 Q9Y468 4/20 0.42
KDM4E B2RXH2 1/20 0.42
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
MAPT P10636 1/20 0.40
GAA P10253 2/20 0.40
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
KDR P35968 1/20 0.38
POLB P06746 1/20 0.37
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37
PABPC1 P11940 1/20 0.37
EIF4H Q15056 1/20 0.37

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
SCHEMBL6987149 0.90 MEN1 (0.41) KCNJ11P2RX7L3MBTL1NPC1RAB9A
SCHEMBL6986808 0.88 RAB9A (0.51) KCNJ11P2RX7ABCC9ABCC8KCNJ8
SCHEMBL6989221 0.87 KCNJ11 (0.45) KCNJ11P2RX7IDO1ABCC9ABCC8
SCHEMBL6991618 0.86 P2RX7 (0.40) KCNJ11P2RX7GAA
SCHEMBL6990462 0.85 KMT2A (0.42) KCNJ11P2RX7L3MBTL1NPC1RAB9A
SCHEMBL6989329 0.81 LMNA (0.50) KCNJ11ABCC9ABCC8KCNJ8L3MBTL1
SCHEMBL6991098 0.80 PLK1 (0.54) KCNJ11ABCC9ABCC8KCNJ8KMT2A
SCHEMBL7559791 0.80 POLB (0.42) KCNJ11P2RX7ABCC9ABCC8KCNJ8
SCHEMBL4256402 0.80 POLB (0.42) KCNJ11P2RX7ABCC9ABCC8KCNJ8
SCHEMBL4256399 0.80 POLB (0.42) KCNJ11P2RX7ABCC9ABCC8KCNJ8

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 KCNJ11 2/4885P2RX7 782/4885IDO1 577/4885

“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.