SCHEMBL25869414

SCHEMBL25869414

O=c1oc2ccc(-c3ccc(OC(P)(P)P)cc3)cc2n1Cc1ncccn1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MET P08581 2/20 0.42
TSPO P30536 1/20 0.42
SCN1A P35498 1/20 0.41
SCN4A P35499 1/20 0.41
KCNH2 Q12809 1/20 0.41
SCN5A Q14524 1/20 0.41
SCN9A Q15858 1/20 0.41
SCN2A Q99250 1/20 0.41
SCN3A Q9NY46 1/20 0.41
SCN8A Q9UQD0 1/20 0.41
SCN10A Q9Y5Y9 1/20 0.41
CD74 P04233 1/20 0.40
MIF P14174 1/20 0.40

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
SCHEMBL22314911 0.89 SCN5A (0.52) METTSPOSCN1ASCN4AKCNH2
SCHEMBL22314557 0.79 SCN5A (0.46) METTSPOSCN1ASCN4AKCNH2
SCHEMBL25865133 0.78 TNIK (0.43) TSPOSCN1ASCN4AKCNH2SCN5A
SCHEMBL22314913 0.75 SCN5A (0.48) SCN1ASCN4AKCNH2SCN5ASCN9A
SCHEMBL22314528 0.73 GRIN1 (0.42) SCN1ASCN4AKCNH2SCN5ASCN9A
SCHEMBL22315048 0.73 TNIK (0.43) TSPOSCN1ASCN4AKCNH2SCN5A
SCHEMBL22314564 0.71 TNIK (0.48) CD74MIF
SCHEMBL25869117 0.70 TSPO (0.52) TSPO
SCHEMBL25868217 0.70 MAPT (0.46) TSPO
SCHEMBL22314889 0.70 TSPO (0.46) TSPO

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-20230219938-A1 COMPOUNDS AND THEIR METHODS OF USE PRAXIS PREC MEDICINES INC (US) 2023-07-13 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-20230219938-A1 COMPOUNDS AND THEIR METHODS OF USE SCN1A, SCN3A, SCN1B MET 3724/4885TSPO 394/4885SCN1A 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.