SCHEMBL25679833

SCHEMBL25679833

O=C(O)c1c(I)ccnc1N1CCC(F)(F)C1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ACACB O00763 8/20 0.39
▸ PDE10A Q9Y233 1/20 0.37
▸ SCN10A Q9Y5Y9 3/20 0.37
▸ HDAC4 P56524 1/20 0.36
▸ CNR2 P34972 3/20 0.35
▸ FFAR2 O15552 1/20 0.35
▸ GSK3A P49840 1/20 0.35
▸ GSK3B P49841 1/20 0.35
▸ GRM4 Q14833 1/20 0.35

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
SCHEMBL25679835 0.78 PDE10A (0.40) ACACBPDE10ACNR2FFAR2GSK3A
SCHEMBL25120593 0.77 PDE10A (0.38) ACACBPDE10ASCN10ACNR2FFAR2
SCHEMBL23611732 0.76 PDE10A (0.40) ACACBPDE10AHDAC4CNR2FFAR2
SCHEMBL25680364 0.75 KDM4E (0.35) —
SCHEMBL30464221 0.73 ABL1 (0.40) ACACBSCN10ACNR2GSK3AGSK3B
SCHEMBL25680300 0.73 ABL1 (0.40) ACACBSCN10ACNR2GSK3AGSK3B
SCHEMBL25680315 0.73 SCN10A (0.38) ACACBSCN10AGSK3AGSK3B
SCHEMBL30464194 0.73 ATR (0.40) ACACBSCN10ACNR2GSK3AGSK3B
SCHEMBL25680244 0.73 NAMPT (0.50) —
SCHEMBL31214575 0.72 PROKR1 (0.36) ACACBPDE10ASCN10ACNR2

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-20230203007-A1 PYRIDINYLACETAMIDE DERIVATIVES AS SODIUM CHANNEL ACTIVATORS X-CHEM GLOBAL HQ 2023-06-29 — — 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-20230203007-A1 PYRIDINYLACETAMIDE DERIVATIVES AS SODIUM CHANNEL ACTIVATORS SCN1A, SCN3A, SCN2A ACACB 4227/4885PDE10A 940/4885SCN10A 16/4885

“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.

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