SCHEMBL20635482

SCHEMBL20635482

CN1CC(=O)N2CCc3c(c4cc(OCCN5CCOCC5)ccc4n3Cc3ccc(C(=O)O)cc3)C2C1O

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ HDAC6 Q9UBN7 13/20 0.58
▸ HDAC2 Q92769 10/20 0.58
▸ HDAC8 Q9BY41 8/20 0.58
▸ HDAC1 Q13547 8/20 0.52
▸ HDAC3 O15379 7/20 0.52
▸ HDAC10 Q969S8 1/20 0.52
▸ KDM4E B2RXH2 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ CNR1 P21554 1/20 0.40
▸ ESR1 P03372 2/20 0.40
▸ ESR2 Q92731 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
SCHEMBL20629348 0.93 HDAC6 (0.67) HDAC6HDAC2HDAC8HDAC1HDAC3
SCHEMBL20629290 0.86 HDAC6 (0.58) HDAC6HDAC2HDAC8HDAC1HDAC3
SCHEMBL20629461 0.84 HDAC6 (0.63) HDAC6HDAC2HDAC8HDAC1HDAC3
SCHEMBL20635874 0.83 HDAC6 (0.48) HDAC6HDAC2HDAC8HDAC1HDAC3
SCHEMBL20629485 0.80 HDAC6 (0.69) HDAC6HDAC2HDAC8HDAC1HDAC3
SCHEMBL20635578 0.80 HDAC6 (0.58) HDAC6HDAC2HDAC8HDAC1HDAC3
Hydrochloric Acid SCHEMBL20605308 0.80 HDAC6 (0.70) HDAC6HDAC2HDAC8HDAC1HDAC3
SCHEMBL20605326 0.79 HDAC6 (0.85) HDAC6HDAC2HDAC8HDAC1HDAC3
SCHEMBL20635859 0.79 HDAC6 (0.85) HDAC6HDAC2HDAC8HDAC1HDAC3
SCHEMBL22467792 0.79 HDAC6 (0.85) HDAC6HDAC2HDAC8HDAC1HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11198694-B2 HDAC6 inhibitors, with improved solubility and their uses UNIVERSITÄT REGENSBURG (DE) 2021-12-14 — — US disclosed
WO-2019007836-A1 NOVEL HDAC6 INHIBITORS, WITH IMPROVED SOLUBILITY AND THEIR USES UNIVERSITÄT REGENSBURG (DE) 2019-01-10 — — 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-11198694-B2 HDAC6 inhibitors, with improved solubility and their uses HDAC6, HDAC1, HDAC5 HDAC6 1/4885HDAC2 4/4885HDAC8 6/4885

“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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