SCHEMBL29721765

SCHEMBL29721765

Nc1c(NC(=O)OC2CC2)ccc(NCc2ncc(C(F)(F)F)cc2F)c1F

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNQ2 O43526 9/20 0.73
▸ KCNQ3 O43525 8/20 0.73
▸ KCNQ4 P56696 5/20 0.73
▸ KCNQ5 Q9NR82 5/20 0.73
▸ GNRHR P30968 1/20 0.35
▸ GPR35 Q9HC97 1/20 0.34
▸ CCNE1 P24864 1/20 0.34
▸ CDK2 P24941 1/20 0.34
▸ CYP2C9 P11712 2/20 0.33
▸ CYP2C19 P33261 2/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ BACE1 P56817 1/20 0.33
▸ NTRK1 P04629 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ CHRM2 P08172 1/20 0.33

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
SCHEMBL21501774 1.00 KCNQ2 (0.73) KCNQ2KCNQ3KCNQ4KCNQ5GNRHR
SCHEMBL21501785 0.88 KCNQ2 (0.80) KCNQ2KCNQ3KCNQ4KCNQ5GNRHR
SCHEMBL29721679 0.88 KCNQ2 (0.80) KCNQ2KCNQ3KCNQ4KCNQ5GNRHR
SCHEMBL29721511 0.88 KCNQ2 (0.80) KCNQ2KCNQ3KCNQ4KCNQ5GNRHR
SCHEMBL21501814 0.88 KCNQ2 (0.80) KCNQ2KCNQ3KCNQ4KCNQ5GNRHR
SCHEMBL21501777 0.85 KCNQ2 (0.74) KCNQ2KCNQ3KCNQ4KCNQ5CCNE1
SCHEMBL29721508 0.85 KCNQ2 (0.74) KCNQ2KCNQ3KCNQ4KCNQ5CCNE1
SCHEMBL21496312 0.84 KCNQ2 (0.52) KCNQ2KCNQ3KCNQ4KCNQ5CYP2C9
SCHEMBL21501771 0.84 KCNQ2 (0.75) KCNQ2KCNQ3KCNQ4KCNQ5GPR35
SCHEMBL29721764 0.84 KCNQ2 (0.75) KCNQ2KCNQ3KCNQ4KCNQ5GPR35

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11358930-B2 Selective potassium channel agonists University of Pittsburgh—of the Commonwealth System of Higher Education (US) 2022-06-14 — — 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-11358930-B2 Selective potassium channel agonists KCNH3, KCNH2, KCNJ11 KCNQ2 35/4885KCNQ3 43/4885KCNQ4 48/4885

“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.

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