SCHEMBL25864996

SCHEMBL25864996

COc1ccc(-c2ccc3oc(=O)n(CC(C)=O)c3c2)cc1

nearest known ligand 0.68

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSPO P30536 1/20 0.68
CBX7 O95931 6/20 0.58
CDYL2 Q8N8U2 6/20 0.58
CDYL Q9Y232 6/20 0.58
CDY1; CDY1B Q9Y6F8 4/20 0.58
KMO O15229 1/20 0.56
TP53 P04637 1/20 0.50
MAPT P10636 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50

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
SCHEMBL25865036 0.86 TSPO (0.53) TSPO
SCHEMBL14426217 0.86 TSPO (0.59) TSPO
SCHEMBL25869117 0.85 TSPO (0.52) TSPOCBX7CDYL2CDYLCDY1; CDY1B
SCHEMBL25868351 0.85 TSPO (0.52) TSPO
SCHEMBL29957877 0.79 KMO (0.76) TSPOCBX7CDYL2CDYLCDY1; CDY1B
SCHEMBL2950965 0.79 KMO (0.76) TSPOCBX7CDYL2CDYLCDY1; CDY1B
SCHEMBL29958210 0.78 CDYL2 (0.69) TSPOCBX7CDYL2CDYLCDY1; CDY1B
SCHEMBL27033393 0.78 CDYL2 (0.69) TSPOCBX7CDYL2CDYLCDY1; CDY1B
SCHEMBL25864993 0.77 MEN1 (0.54) TSPOKMOTP53MAPTSMN1; SMN2
SCHEMBL30538038 0.76 CBX7 (0.60) CBX7CDYL2CDYLCDY1; CDY1BTP53

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 TSPO 394/4885CBX7 1133/4885CDYL2 1702/4885

“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.