SCHEMBL25820588

SCHEMBL25820588

Cc1cc2ccn([C@H]3CC3N(C)C)c2cc1C

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 1/20 0.32
MEN1 O00255 1/20 0.30
PABPC1 P11940 1/20 0.30
KMT2A Q03164 1/20 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
SCHEMBL24110197 1.00 SCN9A (0.32) SCN9AMEN1PABPC1KMT2A
SCHEMBL25822729 0.88 SCN9A (0.37) SCN9A
SCHEMBL24110294 0.88 SCN9A (0.35) SCN9A
SCHEMBL24110198 0.88 SCN9A (0.37) SCN9A
SCHEMBL24109738 0.86 SCN9A (0.35) SCN9AMEN1PABPC1KMT2A
SCHEMBL25825529 0.86 SLC6A2 (0.32) SCN9A
SCHEMBL24110195 0.86 SLC6A2 (0.32) SCN9A
SCHEMBL24110204 0.86 SLC6A2 (0.32) SCN9A
SCHEMBL24109740 0.83 HTR2A (0.37)
SCHEMBL24110263 0.83 HTR2A (0.43) SCN9A

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-20230219969-A1 ISOTRYPTAMINE PSYCHOPLASTOGENS AND USES THEREOF DELIX THERAPEUTICS, INC. 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-20230219969-A1 ISOTRYPTAMINE PSYCHOPLASTOGENS AND USES THEREOF GAP43, SLC18A2, PNMT SCN9A 3315/4885MEN1 3118/4885PABPC1 2397/4885

“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.