SCHEMBL19686204

SCHEMBL19686204

NC(COc1cncc(C(F)(F)F)c1)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SCN4A P35499 6/20 0.54
▸ AKT1 P31749 3/20 0.54
▸ TACR1 P25103 3/20 0.52
▸ CACNA1F O60840 1/20 0.52
▸ CACNA1D Q01668 1/20 0.52
▸ CACNA1S Q13698 1/20 0.52
▸ CACNA1C Q13936 1/20 0.52
▸ CDK7 P50613 2/20 0.42
▸ CDK2 P24941 1/20 0.42
▸ SCN9A Q15858 1/20 0.42

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
SCHEMBL19668648 0.84 TACR1 (0.67) SCN4ATACR1CACNA1FCACNA1DCACNA1S
SCHEMBL4990397 0.82 SCN4A (0.63) SCN4ATACR1CACNA1FCACNA1DCACNA1S
SCHEMBL19686194 0.79 SCN4A (0.58) SCN4AAKT1TACR1CDK7CDK2
SCHEMBL875373 0.76 MRGPRX4 (0.47) —
SCHEMBL19686203 0.75 SCN4A (0.57) SCN4AAKT1TACR1CACNA1FCACNA1D
SCHEMBL19686722 0.74 SCN4A (0.55) SCN4AAKT1TACR1CACNA1FCACNA1D
SCHEMBL19668462 0.74 TACR1 (0.53) SCN4AAKT1TACR1CACNA1FCACNA1D
SCHEMBL2394573 0.74 SCN4A (0.69) SCN4AAKT1
SCHEMBL19686108 0.74 SCN4A (0.69) SCN4AAKT1
SCHEMBL19686114 0.72 SCN4A (0.47) SCN4AAKT1TACR1CACNA1FCACNA1D

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-20190270696-A1 COMPOUNDS AS INHIBITORS OF SODIUM CHANNELS HUMAN BIOMOLECULAR RESEARCH INSTITUTE (US) 2019-09-05 — — US disclosed
WO-2017210371-A2 COMPOUNDS AS INHIBITORS OF SODIUM CHANNELS HUMAN BIOMOLECULAR RESEARCH INSTITUTE (US) 2017-12-07 — — 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-20190270696-A1 COMPOUNDS AS INHIBITORS OF SODIUM CHANNELS SCN1B, CACNA1E, SCN2B SCN4A 48/4885AKT1 1612/4885TACR1 174/4885

“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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