SCHEMBL29754138

SCHEMBL29754138

COC(=O)c1cccc2c1CC1(CCN(Cc3ccc(C(F)(F)F)c(Cl)c3)C1=O)C2

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HDAC11 Q96DB2 12/20 0.57
HDAC6 Q9UBN7 2/20 0.35
NR1H2 P55055 2/20 0.35
NR1H3 Q13133 1/20 0.34
OPRK1 P41145 1/20 0.33
PHGDH O43175 1/20 0.33
CTSB P07858 1/20 0.33
CTSS P25774 1/20 0.33
CTSK P43235 1/20 0.33
MGLL Q99685 1/20 0.33

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
SCHEMBL20836890 0.93 HDAC11 (0.57) HDAC11
SCHEMBL29624696 0.93 HDAC11 (0.57) HDAC11
SCHEMBL20096556 0.93 HDAC11 (0.57) HDAC11
SCHEMBL20096553 0.93 HDAC11 (0.57) HDAC11
SCHEMBL29624687 0.93 HDAC11 (0.57) HDAC11
SCHEMBL20096675 0.91 HDAC11 (0.58) HDAC11HDAC6NR1H2
SCHEMBL20132806 0.87 HDAC11 (0.62) HDAC11HDAC6
SCHEMBL20132808 0.86 HDAC11 (0.64) HDAC11HDAC6
SCHEMBL20096998 0.84 HDAC11 (0.64) HDAC11CTSBCTSSCTSK
SCHEMBL20132854 0.82 HDAC11 (0.73) HDAC11HDAC6

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-20220235018-A1 METHODS USING HDAC11 INHIBITORS Valo Health, LLC 2022-07-28 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-20220235018-A1 METHODS USING HDAC11 INHIBITORS HDAC11, HDAC1, HDAC10 HDAC11 1/4885HDAC6 6/4885NR1H2 1484/4885

“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.