SCHEMBL25992740

SCHEMBL25992740

Cc1cccc(-c2cn(Cc3ccc(-c4nnc(C(F)F)o4)cc3)nn2)c1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TEK Q02763 10/20 0.61
▸ KDR P35968 10/20 0.61
▸ EPHB4 P54760 4/20 0.61
▸ HDAC6 Q9UBN7 3/20 0.54
▸ NPC1 O15118 2/20 0.51
▸ RAB9A P51151 2/20 0.51
▸ ROCK2 O75116 1/20 0.47
▸ GSK3B P49841 1/20 0.47
▸ AURKB Q96GD4 1/20 0.47
▸ MEN1 O00255 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ ESRRG P62508 1/20 0.44
▸ CYP19A1 P11511 1/20 0.44

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
SCHEMBL25992735 0.90 HDAC6 (0.57) TEKKDREPHB4HDAC6NPC1
SCHEMBL25216837 0.88 HDAC6 (0.55) TEKKDREPHB4HDAC6ROCK2
SCHEMBL30409508 0.88 HDAC6 (0.55) TEKKDREPHB4HDAC6NPC1
SCHEMBL24216740 0.88 HDAC6 (0.55) TEKKDREPHB4HDAC6NPC1
SCHEMBL30410153 0.88 TEK (0.61) TEKKDREPHB4HDAC6NPC1
SCHEMBL25254106 0.88 TEK (0.61) TEKKDREPHB4HDAC6NPC1
SCHEMBL24215760 0.87 HDAC6 (0.52) TEKKDREPHB4HDAC6NPC1
SCHEMBL30409054 0.87 HDAC6 (0.52) TEKKDREPHB4HDAC6NPC1
SCHEMBL24215835 0.87 HDAC6 (0.62) TEKKDREPHB4HDAC6NPC1
SCHEMBL31535159 0.86 HDAC6 (0.57) TEKKDREPHB4HDAC6ROCK2

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-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

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 TEK 3885/4885KDR 4706/4885EPHB4 4876/4885

“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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