SCHEMBL20096483

SCHEMBL20096483

O=C(NO)c1cccc2c1CC1(CCN(Cc3cccc(Cl)c3)C1=O)C2

nearest known ligand 0.79

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HDAC11 Q96DB2 12/20 0.79
HDAC6 Q9UBN7 2/20 0.47
HCRTR2 O43614 3/20 0.42
HCRTR1 O43613 2/20 0.42
MAPT P10636 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
PTGER4 P35408 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC8 Q9BY41 1/20 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
SCHEMBL20096840 0.91 HDAC11 (0.83) HDAC11HDAC6HDAC1HDAC8
SCHEMBL20096922 0.91 HDAC11 (0.83) HDAC11HDAC6HDAC1
SCHEMBL20096737 0.90 HDAC11 (0.78) HDAC11HDAC6PTGER4HDAC1
SCHEMBL20096852 0.89 HDAC11 (0.81) HDAC11HDAC6HDAC1HDAC8
SCHEMBL20096740 0.89 HDAC11 (1.00) HDAC11HDAC6HCRTR2HCRTR1HDAC1
SCHEMBL20096467 0.89 HDAC11 (0.82) HDAC11HDAC6PTGER4HDAC1
SCHEMBL20096900 0.88 HDAC11 (0.78) HDAC11HDAC6HCRTR2HCRTR1HDAC1
SCHEMBL20096902 0.87 HDAC11 (0.80) HDAC11HDAC6HDAC1HDAC8
SCHEMBL20096907 0.87 HDAC11 (1.00) HDAC11HDAC6HDAC1
SCHEMBL20096858 0.86 HDAC11 (1.00) HDAC11HDAC6HDAC1

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 1/4885HDAC6 6/4885HCRTR2 3496/4885
US-20180127386-A1 METHODS USING HDAC11 INHIBITORS HDAC11, HDAC1, HDAC10 HDAC11 1/4885HDAC6 6/4885HCRTR2 3496/4885
US-20190084945-A1 METHODS USING HDAC11 INHIBITORS HDAC11, HDAC1, HDAC10 HDAC11 1/4885HDAC6 6/4885HCRTR2 3496/4885
US-20190084946-A1 METHODS USING HDAC11 INHIBITORS HDAC11, HDAC1, HDAC10 HDAC11 1/4885HDAC6 6/4885HCRTR2 3496/4885

“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.