SCHEMBL20096604

SCHEMBL20096604

O=C(NO)c1cccc2c1CC1(CCN(c3ccccc3C(F)(F)F)C1=O)C2

nearest known ligand 0.69

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HDAC11 Q96DB2 15/20 0.69
LMNA P02545 1/20 0.43
GAA P10253 1/20 0.43
CXCR5 P32302 1/20 0.35
P2RX7 Q99572 1/20 0.35
NOTUM Q6P988 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34

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
SCHEMBL20132866 0.92 HDAC11 (0.70) HDAC11LMNAGAACXCR5NOTUM
SCHEMBL20096865 0.92 HDAC11 (0.72) HDAC11LMNAGAANOTUMHDAC6
SCHEMBL29754223 0.92 HDAC11 (0.72) HDAC11LMNAGAANOTUMHDAC6
SCHEMBL20096493 0.83 HDAC11 (0.85) HDAC11
SCHEMBL20096482 0.82 HDAC11 (1.00) HDAC11LMNAGAAHDAC6
SCHEMBL20096682 0.82 HDAC11 (1.00) HDAC11CXCR5
SCHEMBL29754216 0.80 HDAC11 (0.56) HDAC11P2RX7NOTUM
SCHEMBL20096864 0.80 HDAC11 (0.56) HDAC11P2RX7NOTUM
SCHEMBL20096912 0.79 HDAC11 (0.86) HDAC11LMNAGAAP2RX7HDAC6
SCHEMBL20096669 0.77 HDAC11 (0.64) 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 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 1/4885LMNA 2556/4885GAA 181/4885
US-20180127386-A1 METHODS USING HDAC11 INHIBITORS HDAC11, HDAC1, HDAC10 HDAC11 1/4885LMNA 2556/4885GAA 181/4885
US-20190084945-A1 METHODS USING HDAC11 INHIBITORS HDAC11, HDAC1, HDAC10 HDAC11 1/4885LMNA 2556/4885GAA 181/4885
US-20190084946-A1 METHODS USING HDAC11 INHIBITORS HDAC11, HDAC1, HDAC10 HDAC11 1/4885LMNA 2556/4885GAA 181/4885

“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.