SCHEMBL26539323

SCHEMBL26539323

COCc1cc2nnc(C(C)(F)F)n2nc1-c1ccc(OC(F)(F)F)cc1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 6/20 0.49
SCN5A Q14524 8/20 0.46
SCN1A P35498 1/20 0.41
SCN2A Q99250 1/20 0.41
DYRK1A Q13627 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
CACNA2D1 P54289 1/20 0.35
PIM1 P11309 1/20 0.35
KCNH2 Q12809 1/20 0.34
SCN10A Q9Y5Y9 1/20 0.34
ALDH1A1 P00352 2/20 0.34
RAB9A P51151 1/20 0.34

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
SCHEMBL20203969 0.92 CYP1A2 (0.58) CYP1A2SCN5ASCN1ASCN2ADYRK1A
SCHEMBL26539441 0.88 SCN5A (0.46) CYP1A2SCN5ASCN1ASCN2ACACNA2D1
SCHEMBL26539329 0.82 SCN5A (0.50) CYP1A2SCN5ASCN1ASCN2ACACNA2D1
SCHEMBL26539447 0.82 SCN5A (0.50) CYP1A2SCN5ASCN1ASCN2ACACNA2D1
SCHEMBL26539353 0.81 SCN5A (0.49) CYP1A2SCN5ASCN1ASCN2AL3MBTL1
SCHEMBL26539455 0.81 SCN5A (0.49) CYP1A2SCN5ASCN1ASCN2AL3MBTL1
SCHEMBL26539463 0.81 CYP1A2 (0.50) CYP1A2SCN5ASCN1ASCN2ADYRK1A
SCHEMBL20191087 0.78 SCN5A (0.57) CYP1A2SCN5ASCN1ASCN2AL3MBTL1
SCHEMBL20203983 0.78 SCN5A (0.57) CYP1A2SCN5ASCN1ASCN2AL3MBTL1
SCHEMBL26539438 0.78 SCN5A (0.46) CYP1A2SCN5ASCN1ASCN2AL3MBTL1

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-20230322790-A1 COMPOUNDS AND THEIR METHODS OF USE PRAXIS PRECISION MEDICINES, INC. 2023-10-12 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-20230322790-A1 COMPOUNDS AND THEIR METHODS OF USE SCN1A, SCN3A, SCN1B CYP1A2 1988/4885SCN5A 8/4885SCN1A 1/4885

“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.