SCHEMBL7148288

SCHEMBL7148288

COC(=O)C1=C(C)NC2=C(C(=O)C(C)OC2)C1c1ccc(F)c(Br)c1

nearest known ligand 0.64

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ABCC9 O60706 18/20 0.64
KCNJ11 Q14654 18/20 0.64
ABCC8 Q09428 7/20 0.58
KCNJ8 Q15842 7/20 0.58
LMNA P02545 1/20 0.49
TSHR P16473 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49

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
SCHEMBL7148011 0.85 ABCC9 (0.62) ABCC9KCNJ11ABCC8KCNJ8LMNA
SCHEMBL5075485 0.85 ABCC9 (0.68) ABCC9KCNJ11ABCC8KCNJ8
SCHEMBL6925767 0.81 ABCC9 (0.66) ABCC9KCNJ11ABCC8KCNJ8LMNA
SCHEMBL7101054 0.80 ABCC9 (0.69) ABCC9KCNJ11ABCC8KCNJ8LMNA
SCHEMBL7101463 0.80 ABCC9 (0.64) ABCC9KCNJ11ABCC8KCNJ8
SCHEMBL7575450 0.79 ABCC9 (0.63) ABCC9KCNJ11ABCC8KCNJ8LMNA
SCHEMBL7146520 0.78 ABCC9 (1.00) ABCC9KCNJ11ABCC8KCNJ8
SCHEMBL7146526 0.78 ABCC9 (1.00) ABCC9KCNJ11ABCC8KCNJ8
SCHEMBL7153567 0.78 ABCC9 (1.00) ABCC9KCNJ11ABCC8KCNJ8
SCHEMBL7838750 0.78 ABCC9 (0.62) ABCC9KCNJ11ABCC8KCNJ8LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6642222-B2 Useful in hyperpolarizing cell membranes, opening potassium channels, relaxing smooth muscle cells, and inhibiting bladder contractions ABBOTT LABORATORIES 2003-11-04 US disclosed
US-20030055035-A1 Pyrano piperidino and thiopyrano compounds and methods of use ABBOTT LABORATORIES 2003-03-20 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-20030055035-A1 Pyrano piperidino and thiopyrano compounds and methods of use KCNJ3, KCNJ6, KCNJ5 ABCC9 632/4885KCNJ11 4/4885ABCC8 915/4885

“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.