SCHEMBL25329331

SCHEMBL25329331

CCc1c(C)c(O)c(C)c(C)c1OCC(C)C

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SCN5A Q14524 1/20 0.33
ADRA1D P25100 1/20 0.31
ADRA1A P35348 1/20 0.31
ADRA1B P35368 1/20 0.31
CACNA1G O43497 2/20 0.30
CACNA1H O95180 2/20 0.30
CACNA1I Q9P0X4 2/20 0.30

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
SCHEMBL25329828 0.91 SCN5A (0.33) SCN5ACACNA1GCACNA1HCACNA1I
SCHEMBL30356486 0.89 SCN5A (0.33) SCN5ACACNA1GCACNA1HCACNA1I
SCHEMBL25329836 0.87 SCN5A (0.33) SCN5ACACNA1GCACNA1HCACNA1I
SCHEMBL25330293 0.86 SCN5A (0.33) SCN5ACACNA1GCACNA1HCACNA1I
SCHEMBL25331313 0.85 SCN5A (0.38) SCN5A
SCHEMBL25330737 0.84 SCN5A (0.33) SCN5ACACNA1GCACNA1HCACNA1I
SCHEMBL25331693 0.83 SCN5A (0.35) SCN5ACACNA1GCACNA1HCACNA1I
SCHEMBL25329094 0.81 IMPDH2 (0.33) ADRA1DADRA1AADRA1B
SCHEMBL25328876 0.78
SCHEMBL25329481 0.78 PTGS1 (0.32)

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12583813-B2 Polymerization inhibitors BASF SE (DE) 2026-03-24 US disclosed
US-20230242472-A1 POLYMERIZATION INHIBITORS BASF SE (DE) 2023-08-03 US disclosed
EP-4161892-A1 POLYMERIZATION INHIBITORS BASF SE (DE) 2023-04-12 EP 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-20230242472-A1 POLYMERIZATION INHIBITORS RCE1, CABLES1, DPYD SCN5A 4507/4885ADRA1D 4718/4885ADRA1A 4695/4885
US-12583813-B2 Polymerization inhibitors PTGS1, PTGER1, POT1 SCN5A 4630/4885ADRA1D 324/4885ADRA1A 763/4885

“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.