SCHEMBL26539129

SCHEMBL26539129

COCc1cc(OC(F)(F)F)ccc1-c1cn2c(C(C)(F)F)nnc2cn1

nearest known ligand 0.87

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 10/20 0.87
SCN5A Q14524 3/20 0.44
SCN1A P35498 1/20 0.38
SCN2A Q99250 1/20 0.38
RXRA P19793 4/20 0.37
GRIN1 Q05586 4/20 0.37
GRIN2B Q13224 4/20 0.37
DYRK1A Q13627 1/20 0.36
CBFB Q13951 1/20 0.33
ALKBH1 Q13686 1/20 0.33

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
SCHEMBL20203838 0.93 CYP1A2 (1.00) CYP1A2SCN5ASCN1ASCN2ARXRA
SCHEMBL31733960 0.92 CYP1A2 (0.87) CYP1A2SCN5ASCN1ASCN2ARXRA
SCHEMBL21835764 0.91 CYP1A2 (0.85) CYP1A2SCN5ASCN1ASCN2ARXRA
SCHEMBL24155936 0.91 CYP1A2 (0.85) CYP1A2SCN5ASCN1ASCN2ARXRA
SCHEMBL21835657 0.90 CYP1A2 (0.83) CYP1A2SCN5ASCN1ASCN2ARXRA
SCHEMBL24156001 0.89 CYP1A2 (0.81) CYP1A2SCN5ASCN1ASCN2ARXRA
SCHEMBL26539274 0.86 CYP1A2 (0.88) CYP1A2SCN5ARXRAGRIN1GRIN2B
SCHEMBL20203876 0.85 CYP1A2 (0.75) CYP1A2SCN5ARXRAGRIN1GRIN2B
SCHEMBL26539151 0.85 CYP1A2 (0.66) CYP1A2SCN5ASCN1ASCN2ARXRA
SCHEMBL26539324 0.84 CYP1A2 (0.74) CYP1A2SCN5ARXRAGRIN1GRIN2B

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.