SCHEMBL21288068

SCHEMBL21288068

C[C@H](NC(=O)CCC(C)(C)C)c1cccc(OC(F)F)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNK2 O95069 1/20 0.48
KCNA5 P22460 1/20 0.48
KCNH2 Q12809 1/20 0.48
KCNB1 Q14721 1/20 0.48
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
GPR139 Q6DWJ6 5/20 0.46
LMNA P02545 2/20 0.43
MAPT P10636 1/20 0.43
POLB P06746 2/20 0.42
ACACB O00763 1/20 0.42
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 2/20 0.42
HPGD P15428 1/20 0.42
GAA P10253 1/20 0.42
ROCK2 O75116 2/20 0.41
ROCK1 Q13464 2/20 0.41
CYP3A4 P08684 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
SCHEMBL25846583 1.00 KCNK2 (0.48) KCNK2KCNA5KCNH2KCNB1MEN1
SCHEMBL22970326 0.89 GPR139 (0.58) MEN1KMT2AGPR139LMNAMAPT
SCHEMBL21295101 0.89 GPR139 (0.58) MEN1KMT2AGPR139LMNAMAPT
SCHEMBL29676043 0.87 KCNK2 (0.49) KCNK2KCNA5KCNH2KCNB1MEN1
SCHEMBL21272579 0.85 KCNK2 (0.48) KCNK2KCNA5KCNH2KCNB1MEN1
SCHEMBL28459108 0.85 KCNK2 (0.48) KCNK2KCNA5KCNH2KCNB1MEN1
SCHEMBL29467077 0.85 KCNK2 (0.48) KCNK2KCNA5KCNH2KCNB1MEN1
SCHEMBL21303094 0.84 MEN1 (0.45) KCNH2MEN1KMT2AGPR139LMNA
SCHEMBL21288072 0.84 MEN1 (0.45) KCNH2MEN1KMT2AGPR139LMNA
SCHEMBL22952815 0.84 KDM4E (0.40) KCNK2KCNA5KCNH2KCNB1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4241843-A2 ALCOHOL DERIVATIVES AS KV7 POTASSIUM CHANNEL OPENERS H. Lundbeck A/S (DK) 2023-09-13 EP disclosed
WO-2021023616-A1 ALCOHOL DERIVATIVES AS KV7 POTASSIUM CHANNEL OPENERS FOR USE IN EPILEPSY OR SEIZURES H. LUNDBECK A/S (DK) 2021-02-11 WO disclosed
US-20200172474-A1 ALCOHOL DERIVATIVES AS KV7 POTASSIUM CHANNEL OPENERS H. LUNDBECK A/S (DK) 2020-06-04 US disclosed
WO-2019161877-A1 ALCOHOL DERIVATIVES AS KV7 POTASSIUM CHANNEL OPENERS H. LUNDBECK A/S (DK) 2019-08-29 WO disclosed
US-20190256456-A1 ALCOHOL DERIVATIVES AS KV7 POTASSIUM CHANNEL OPENERS H. LUNDBECK A/S (DK) 2019-08-22 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 (2 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-20190256456-A1 ALCOHOL DERIVATIVES AS KV7 POTASSIUM CHANNEL OPENERS KCNA7, KCNK17, KCNQ1 KCNK2 18/4885KCNA5 16/4885KCNH2 21/4885
US-20200172474-A1 ALCOHOL DERIVATIVES AS KV7 POTASSIUM CHANNEL OPENERS KCNA7, KCNK17, KCNQ1 KCNK2 18/4885KCNA5 16/4885KCNH2 21/4885

“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.