SCHEMBL20096648

SCHEMBL20096648

COC(=O)c1cccc(Nc2nc3cc(F)c(C#N)cc3n2C)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.44
▸ TSHR P16473 2/20 0.44
▸ TP53 P04637 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ HDAC11 Q96DB2 1/20 0.43
▸ HDAC6 Q9UBN7 3/20 0.42
▸ PDE5A O76074 1/20 0.41
▸ ROCK1 Q13464 1/20 0.41
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ EGFR P00533 2/20 0.39
▸ ERBB2 P04626 2/20 0.39
▸ ABCB1 P08183 1/20 0.39
▸ ABCG2 Q9UNQ0 1/20 0.39
▸ MAPT P10636 2/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ PTK2 Q05397 2/20 0.39
▸ BRAF P15056 1/20 0.39
▸ ABL1 P00519 1/20 0.38

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
SCHEMBL20096645 0.88 HDAC6 (0.56) HDAC11HDAC6
SCHEMBL20096421 0.87 HDAC11 (0.51) LMNATSHRTP53MAPK1HDAC11
SCHEMBL20096570 0.85 HDAC11 (0.53) LMNATSHRTP53MAPK1HDAC11
SCHEMBL29754097 0.85 HDAC11 (0.53) LMNATSHRTP53MAPK1HDAC11
SCHEMBL20096823 0.80 MAPT (0.50) LMNATSHRTP53MAPK1HDAC11
SCHEMBL20096557 0.78 KIF11 (0.45) LMNATSHRTP53MAPK1HDAC11
SCHEMBL20132892 0.77 HDAC11 (0.52) HDAC11HDAC6MEN1KMT2AABCG2
SCHEMBL20096698 0.77 KIF11 (0.46) TSHRHDAC11MAPT
SCHEMBL20096463 0.76 HDAC11 (0.57) LMNATSHRTP53MAPK1HDAC11
SCHEMBL20096420 0.76 HDAC11 (0.64) HDAC11HDAC6BRAF

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 LMNA 2556/4885TSHR 3985/4885TP53 699/4885
US-20180127386-A1 METHODS USING HDAC11 INHIBITORS HDAC11, HDAC1, HDAC10 LMNA 2556/4885TSHR 3985/4885TP53 699/4885
US-20190084945-A1 METHODS USING HDAC11 INHIBITORS HDAC11, HDAC1, HDAC10 LMNA 2556/4885TSHR 3985/4885TP53 699/4885
US-20190084946-A1 METHODS USING HDAC11 INHIBITORS HDAC11, HDAC1, HDAC10 LMNA 2556/4885TSHR 3985/4885TP53 699/4885

“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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