SCHEMBL24216445

SCHEMBL24216445

CN(C)c1cccc(-c2cn(Cc3ccc(-c4nnc(C(F)F)o4)cc3F)nn2)c1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ HDAC1 Q13547 17/20 0.47
▸ ROCK2 O75116 1/20 0.41
▸ PAK4 O96013 1/20 0.41
▸ PIM1 P11309 1/20 0.41
▸ GSK3B P49841 1/20 0.41
▸ AURKB Q96GD4 1/20 0.41
▸ HDAC6 Q9UBN7 2/20 0.40

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
SCHEMBL30409407 1.00 HDAC1 (0.47) HDAC1ROCK2PAK4PIM1GSK3B
SCHEMBL25992738 0.88 TEK (0.47) HDAC1ROCK2PAK4PIM1GSK3B
SCHEMBL30410054 0.87 HDAC1 (0.42) HDAC1ROCK2PAK4PIM1GSK3B
SCHEMBL24215788 0.87 HDAC1 (0.42) HDAC1ROCK2PAK4PIM1GSK3B
SCHEMBL30409054 0.87 HDAC6 (0.52) HDAC1HDAC6
SCHEMBL24215760 0.87 HDAC6 (0.52) HDAC1HDAC6
SCHEMBL24215834 0.86 HDAC1 (0.48) HDAC1ROCK2PAK4PIM1GSK3B
SCHEMBL30409440 0.86 HDAC1 (0.48) HDAC1ROCK2PAK4PIM1GSK3B
SCHEMBL24216081 0.86 TEK (0.47) HDAC1ROCK2PAK4PIM1GSK3B
SCHEMBL30409885 0.86 TEK (0.47) HDAC1ROCK2PAK4PIM1GSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230257372-A1 NOVEL COMPOUNDS AS HISTONE DEACETYLASE 6 INHIBITOR, AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2023-08-17 — — US disclosed
US-20230257372-A1 NOVEL COMPOUNDS AS HISTONE DEACETYLASE 6 INHIBITOR, AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2023-08-17 — — US disclosed
US-20230257372-A1 NOVEL COMPOUNDS AS HISTONE DEACETYLASE 6 INHIBITOR, AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2023-08-17 — — US disclosed
WO-2022013728-A1 NOVEL COMPOUNDS AS HISTONE DEACETYLASE 6 INHIBITOR, AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2022-01-20 — — WO 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-20230257372-A1 NOVEL COMPOUNDS AS HISTONE DEACETYLASE 6 INHIBITOR, AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME HDAC6, HDAC1, HDAC3 HDAC1 2/4885ROCK2 2366/4885PAK4 754/4885

“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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