SCHEMBL26538995

SCHEMBL26538995

CC1(F)CC(c2nnc3ccc(-c4ccc(OC(F)(F)F)cc4)nn23)C1

nearest known ligand 0.74

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 6/20 0.74
SCN5A Q14524 6/20 0.59
DYRK1A Q13627 4/20 0.39
CLK2 P49760 1/20 0.39
HASPIN Q8TF76 1/20 0.39
SCN1A P35498 1/20 0.38
SCN2A Q99250 1/20 0.38
LRRK2 Q5S007 1/20 0.36
MET P08581 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
SCHEMBL20203733 0.91 CYP1A2 (0.78) CYP1A2SCN5ADYRK1ACLK2HASPIN
SCHEMBL26539083 0.88 CYP1A2 (0.83) CYP1A2SCN5ADYRK1ACLK2HASPIN
SCHEMBL26539084 0.88 CYP1A2 (0.83) CYP1A2SCN5ADYRK1ACLK2HASPIN
SCHEMBL26539055 0.88 CYP1A2 (0.83) CYP1A2SCN5ADYRK1ACLK2HASPIN
SCHEMBL23571320 0.85 CYP1A2 (1.00) CYP1A2SCN5ADYRK1ACLK2HASPIN
SCHEMBL20203794 0.85 CYP1A2 (1.00) CYP1A2SCN5ADYRK1ACLK2HASPIN
SCHEMBL20203758 0.85 CYP1A2 (1.00) CYP1A2SCN5ADYRK1ACLK2HASPIN
SCHEMBL26539001 0.83 CYP1A2 (0.52) CYP1A2SCN5ADYRK1ACLK2HASPIN
SCHEMBL26539195 0.79 CYP1A2 (0.49) CYP1A2SCN5ASCN1ASCN2A
SCHEMBL26539109 0.77 CYP1A2 (0.64) CYP1A2SCN5ADYRK1ACLK2HASPIN

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 8/4885DYRK1A 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.