SCHEMBL957548

SCHEMBL957548

CCN(CC)c1nc(NCC(C)C)ccc1NC(=O)Cc1cc(F)cc(F)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
PSEN1 P49768 12/20 0.38
PSEN2 P49810 12/20 0.38
APH1B Q8WW43 12/20 0.38
NCSTN Q92542 12/20 0.38
APH1A Q96BI3 12/20 0.38
PSENEN Q9NZ42 12/20 0.38
KCNQ3 O43525 2/20 0.37
KCNQ2 O43526 2/20 0.37
CACNA1H O95180 2/20 0.36
ABCB11 O95342 1/20 0.35
ESR1 P03372 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
HTR1A P08908 1/20 0.35
ADRA2A P08913 1/20 0.35
ADORA3 P0DMS8 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35

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
SCHEMBL30796040 1.00 MEN1 (0.41) MEN1KMT2APSEN1PSEN2APH1B
SCHEMBL964013 0.91 MEN1 (0.40) MEN1KMT2APSEN1PSEN2APH1B
SCHEMBL30794749 0.86 KCNQ3 (0.41) MEN1KMT2APSEN1PSEN2APH1B
SCHEMBL30794397 0.86 KCNQ3 (0.51) MEN1KMT2AKCNQ3KCNQ2CACNA1H
SCHEMBL954416 0.86 KCNQ3 (0.41) MEN1KMT2APSEN1PSEN2APH1B
SCHEMBL953813 0.86 KCNQ3 (0.51) MEN1KMT2AKCNQ3KCNQ2CACNA1H
SCHEMBL955731 0.84 MEN1 (0.40) MEN1KMT2AKCNQ3KCNQ2CACNA1H
SCHEMBL953928 0.84 MEN1 (0.40) MEN1KMT2APSEN1PSEN2APH1B
SCHEMBL30796708 0.84 MEN1 (0.40) MEN1KMT2APSEN1PSEN2APH1B
SCHEMBL30795463 0.78 KCNQ2 (0.44) MEN1KMT2APSEN1PSEN2APH1B

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
US-20110003865-A1 NOVEL 2-DIETHYLAMINO-3-AMIDO-6-AMINO-PYRIDINE DERIVATIVES USEFUL AS POTASSIUM CHANNEL ACTIVATORS NEUROSEARCH A/S (DK) 2011-01-06 US claimed
WO-2024054811-A1 COMBINATION THERAPIES INCLUDING METAL CHANNEL ACTIVATORS BIOHAVEN THERAPEUTICS LTD. (VG) 2024-03-14 WO disclosed
WO-2024054807-A1 COMBINATION THERAPIES INCLUDING METAL CHANNEL ACTIVATORS AND TDP-43 MODULATORS BIOHAVEN THERAPEUTICS LTD. (VG) 2024-03-14 WO disclosed
WO-2024050389-A1 COMBINATION THERAPIES INCLUDING METAL CHANNEL ACTIVATORS AND NMDA RECEPTOR ANTAGONISTS BIOHAVEN THERAPEUTICS LTD. (VG) 2024-03-07 WO disclosed
US-20110003865-A1 NOVEL 2-DIETHYLAMINO-3-AMIDO-6-AMINO-PYRIDINE DERIVATIVES USEFUL AS POTASSIUM CHANNEL ACTIVATORS NEUROSEARCH A/S (DK) 2011-01-06 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-20110003865-A1 NOVEL 2-DIETHYLAMINO-3-AMIDO-6-AMINO-PYRIDINE DERIVATIVES USEFUL AS POTASSIUM CHANNEL ACTIVATORS KCNA7, KCNN3, KCNJ2 MEN1 1888/4885KMT2A 940/4885PSEN1 428/4885

“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.