SCHEMBL25351791

SCHEMBL25351791

Fc1cc(-c2nnc(C(F)F)o2)ccc1Cn1cc(-c2ccc(N3CCNCC3)c(F)c2)nn1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HDAC1 Q13547 15/20 0.49
▸ HDAC6 Q9UBN7 1/20 0.42
▸ ROCK2 O75116 1/20 0.38
▸ PAK4 O96013 1/20 0.38
▸ PIM1 P11309 1/20 0.38
▸ GSK3B P49841 1/20 0.38
▸ AURKB Q96GD4 1/20 0.38
▸ NPY2R P49146 1/20 0.38
▸ PSEN1 P49768 1/20 0.38
▸ PSEN2 P49810 1/20 0.38
▸ KCNH2 Q12809 1/20 0.38
▸ APH1B Q8WW43 1/20 0.38
▸ NCSTN Q92542 1/20 0.38
▸ APH1A Q96BI3 1/20 0.38
▸ PSENEN Q9NZ42 1/20 0.38

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
SCHEMBL25351919 0.94 HDAC1 (0.49) HDAC1HDAC6ROCK2PAK4PIM1
SCHEMBL30407953 0.89 HDAC1 (0.49) HDAC1HDAC6ROCK2PAK4PIM1
SCHEMBL24215926 0.89 HDAC1 (0.49) HDAC1HDAC6ROCK2PAK4PIM1
SCHEMBL24215805 0.88 HDAC1 (0.47) HDAC1HDAC6
SCHEMBL30460229 0.88 HDAC1 (0.47) HDAC1HDAC6
SCHEMBL30409445 0.88 HDAC1 (0.48) HDAC1HDAC6
SCHEMBL24216756 0.88 HDAC1 (0.48) HDAC1HDAC6
SCHEMBL30409320 0.85 HDAC1 (0.47) HDAC1HDAC6
SCHEMBL24216787 0.85 HDAC1 (0.47) HDAC1HDAC6
SCHEMBL24216565 0.85 HDAC1 (0.45) HDAC1HDAC6NPY2R

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 5 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
EP-4185586-A1 NOVEL COMPOUNDS AS HISTONE DEACETYLASE 6 INHIBITOR, AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME Chong Kun Dang Pharmaceutical Corp. (KR) 2023-05-31 — — EP disclosed
CN-116133658-A Novel compounds as inhibitors of histone deacetylase 6 and pharmaceutical compositions comprising the same 株式会社 钟根堂 2023-05-16 — — CN 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 2/4885HDAC6 1/4885ROCK2 2366/4885

“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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