SCHEMBL20208538

SCHEMBL20208538

FC(F)(F)Oc1ccc(-c2ccc3ncc(C(F)(F)F)n3n2)cc1

nearest known ligand 0.64

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SCN5A Q14524 5/20 0.64
CYP1A2 P05177 3/20 0.64
DYRK1A Q13627 10/20 0.55
FYN P06241 2/20 0.46
MAPT P10636 1/20 0.43
SCN1A P35498 1/20 0.42
SCN2A Q99250 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
SCHEMBL20208539 0.84 SCN5A (0.60) SCN5ACYP1A2DYRK1AFYN
SCHEMBL20208536 0.84 SCN5A (0.60) SCN5ACYP1A2DYRK1AFYN
SCHEMBL937201 0.78 CYP1A2 (1.00) SCN5ACYP1A2DYRK1ASCN1ASCN2A
SCHEMBL20208558 0.76 SCN5A (0.71) SCN5ACYP1A2FYNMAPTSCN1A
SCHEMBL20209202 0.76 SCN5A (0.64) SCN5ACYP1A2DYRK1AMAPTSCN1A
SCHEMBL937481 0.75 CYP1A2 (0.75) SCN5ACYP1A2DYRK1AMAPTSCN1A
SCHEMBL20208545 0.75 SCN5A (1.00) SCN5ACYP1A2SCN1ASCN2A
SCHEMBL20203774 0.73 CYP1A2 (0.80) SCN5ACYP1A2DYRK1ASCN1ASCN2A
SCHEMBL20208512 0.72 DYRK1A (0.59) SCN5ACYP1A2DYRK1AMAPTSCN1A
SCHEMBL937513 0.72 CYP1A2 (0.70) SCN5ACYP1A2DYRK1ASCN1ASCN2A

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-20210188839-A1 COMPOUNDS AND THEIR METHODS OF USE PRAXIS PRECISION MEDICINES, INC. 2021-06-24 US disclosed
WO-2018098500-A1 COMPOUNDS AND THEIR METHODS OF USE PRAXIS PRECISION MEDICINES, INC. (US) 2018-05-31 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-20210188839-A1 COMPOUNDS AND THEIR METHODS OF USE SCN1A, SCN3A, SCN1B SCN5A 8/4885CYP1A2 1988/4885DYRK1A 4493/4885

“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.