SCHEMBL20203755

SCHEMBL20203755

FC(F)(F)COc1ccc(-c2ccc3nnc(C(F)(F)C(F)(F)F)n3n2)cn1

nearest known ligand 0.84

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 6/20 0.84
SCN5A Q14524 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
GAA P10253 1/20 0.40
ALDH1A1 P00352 2/20 0.39
NPSR1 Q6W5P4 1/20 0.38
TRPV3 Q8NET8 1/20 0.37
MET P08581 3/20 0.37
DGAT1 O75907 1/20 0.36

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
SCHEMBL936862 0.92 CYP1A2 (1.00) CYP1A2SCN5AL3MBTL1ALDH1A1NPSR1
SCHEMBL20203716 0.85 CYP1A2 (0.78) CYP1A2SCN5AL3MBTL1NPSR1TRPV3
SCHEMBL937579 0.83 CYP1A2 (0.75) CYP1A2SCN5AL3MBTL1ALDH1A1NPSR1
SCHEMBL938456 0.82 CYP1A2 (0.73) CYP1A2SCN5AL3MBTL1ALDH1A1TRPV3
SCHEMBL20203715 0.81 CYP1A2 (0.72) CYP1A2SCN5AL3MBTL1NPSR1TRPV3
SCHEMBL20203896 0.77 CYP1A2 (0.69) CYP1A2SCN5AL3MBTL1ALDH1A1MET
SCHEMBL20203743 0.75 CYP1A2 (0.70) CYP1A2SCN5AL3MBTL1ALDH1A1DGAT1
SCHEMBL20203828 0.74 CYP1A2 (0.65) CYP1A2SCN5AL3MBTL1
SCHEMBL23522703 0.74 CYP1A2 (0.68) CYP1A2SCN5AL3MBTL1ALDH1A1MET
SCHEMBL20203897 0.74 CYP1A2 (0.68) CYP1A2SCN5AL3MBTL1ALDH1A1MET

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 4 patents. 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
US-20230322790-A1 COMPOUNDS AND THEIR METHODS OF USE PRAXIS PRECISION MEDICINES, INC. 2023-10-12 US disclosed
US-20210188852-A1 COMPOUNDS AND THEIR METHODS OF USE PRAXIS PRECISION MEDICINES, INC. 2021-06-24 US disclosed
WO-2018098499-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 (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-20210188852-A1 COMPOUNDS AND THEIR METHODS OF USE SCN1A, SCN3A, SCN1B CYP1A2 1988/4885SCN5A 8/4885L3MBTL1 1392/4885
US-20230322790-A1 COMPOUNDS AND THEIR METHODS OF USE SCN1A, SCN3A, SCN1B CYP1A2 1988/4885SCN5A 8/4885L3MBTL1 1392/4885

“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.