SCHEMBL30364270

SCHEMBL30364270

NC(=O)c1ncc(C2CC2)[nH]1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 4/20 0.41
▸ CCNA2 P20248 2/20 0.36
▸ CDK2 P24941 2/20 0.36
▸ CCNA1 P78396 2/20 0.36
▸ HCAR2 Q8TDS4 1/20 0.36
▸ KDM5A P29375 2/20 0.36
▸ KDM5B Q9UGL1 2/20 0.36
▸ SCN9A Q15858 1/20 0.33
▸ PARP1 P09874 1/20 0.33
▸ NPY5R Q15761 1/20 0.33
▸ YTHDF3 Q7Z739 1/20 0.32
▸ YTHDF1 Q9BYJ9 1/20 0.32
▸ YTHDF2 Q9Y5A9 1/20 0.32
▸ PDPK1 O15530 1/20 0.32
▸ DGAT1 O75907 1/20 0.32
▸ SOAT1 P35610 1/20 0.32
▸ IGF1R P08069 1/20 0.32
▸ BRS3 P32247 1/20 0.32
▸ KDM1A O60341 1/20 0.31

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
SCHEMBL8308592 0.70 MAP2K1 (0.38) GSK3BSCN9APDPK1
SCHEMBL2233666 0.70 — —
SCHEMBL27938032 0.70 — —
SCHEMBL279674 0.68 — —
SCHEMBL19710378 0.67 PARP1 (0.39) PARP1
SCHEMBL30190024 0.67 PIN1 (0.47) GSK3BHCAR2SCN9APDPK1
SCHEMBL27785536 0.67 PARP1 (0.38) PARP1PDPK1
SCHEMBL22365025 0.66 — —
SCHEMBL4372514 0.65 DAO (0.40) GSK3BSCN9APDPK1
SCHEMBL31263227 0.65 CSF1R (0.42) GSK3BSCN9APDPK1

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-20230101819-A1 SMYD Inhibitors EPIZYME INC (US) 2023-03-30 — — 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-20230101819-A1 SMYD Inhibitors SMYD3, SMYD2, SMURF2 GSK3B 4079/4885CCNA2 2107/4885CDK2 2647/4885

“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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