SCHEMBL20096911

SCHEMBL20096911

O=C(NO)c1cccc2c1CC1(CCN(Cc3ccc(OCc4ccccc4)cc3)C1=O)C2

nearest known ligand 0.73

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HDAC11 Q96DB2 12/20 0.73
MMP13 P45452 2/20 0.48
MMP9 P14780 2/20 0.44
ADAM17 P78536 2/20 0.44
MMP1 P03956 1/20 0.44
HDAC1 Q13547 2/20 0.42
HDAC6 Q9UBN7 2/20 0.42
MMP2 P08253 1/20 0.41
HRH3 Q9Y5N1 1/20 0.41
HDAC8 Q9BY41 1/20 0.41

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
SCHEMBL20096922 0.91 HDAC11 (0.83) HDAC11HDAC1HDAC6
SCHEMBL20096905 0.87 HDAC11 (0.78) HDAC11MMP13MMP1HDAC1HDAC6
SCHEMBL20096738 0.87 HDAC11 (0.80) HDAC11HDAC1HDAC6
SCHEMBL20096840 0.85 HDAC11 (0.83) HDAC11HDAC1HDAC6HDAC8
SCHEMBL20096475 0.85 HDAC11 (0.77) HDAC11MMP13HDAC6MMP2
SCHEMBL20096858 0.84 HDAC11 (1.00) HDAC11HDAC1HDAC6
SCHEMBL20096900 0.84 HDAC11 (0.78) HDAC11HDAC1HDAC6HDAC8
SCHEMBL20096902 0.83 HDAC11 (0.80) HDAC11MMP13MMP9ADAM17MMP1
SCHEMBL20096483 0.83 HDAC11 (0.79) HDAC11HDAC1HDAC6HDAC8
SCHEMBL20096737 0.82 HDAC11 (0.78) HDAC11HDAC1HDAC6

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-11345672-B2 Methods using HDAC11 inhibitors VALO HEALTH, INC. (US) 2022-05-31 US disclosed
US-20190084946-A1 METHODS USING HDAC11 INHIBITORS Valo Health, LLC 2019-03-21 US disclosed
US-20190084945-A1 METHODS USING HDAC11 INHIBITORS VALO HEALTH, INC. 2019-03-21 US disclosed
US-20180127386-A1 METHODS USING HDAC11 INHIBITORS VALO EARLY DISCOVERY, INC. 2018-05-10 US disclosed
WO-2018075959-A1 METHODS USING HDAC11 INHIBITORS FORMA THERAPEUTICS, INC. (US) 2018-04-26 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 (4 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-11345672-B2 Methods using HDAC11 inhibitors HDAC11, HDAC1, HDAC10 HDAC11 1/4885MMP13 241/4885MMP9 388/4885
US-20180127386-A1 METHODS USING HDAC11 INHIBITORS HDAC11, HDAC1, HDAC10 HDAC11 1/4885MMP13 241/4885MMP9 388/4885
US-20190084945-A1 METHODS USING HDAC11 INHIBITORS HDAC11, HDAC1, HDAC10 HDAC11 1/4885MMP13 241/4885MMP9 388/4885
US-20190084946-A1 METHODS USING HDAC11 INHIBITORS HDAC11, HDAC1, HDAC10 HDAC11 1/4885MMP13 241/4885MMP9 388/4885

“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.