SCHEMBL15065906

SCHEMBL15065906

CN(c1cccnc1)c1ccc(Oc2cccc(F)c2)c(/C=C/C(=O)NO)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC8 Q9BY41 5/20 0.44
▸ HDAC11 Q96DB2 3/20 0.44
▸ HDAC6 Q9UBN7 3/20 0.44
▸ TUBB4A P04350 1/20 0.44
▸ TUBB P07437 1/20 0.44
▸ TUBA3C P0DPH7 1/20 0.44
▸ TUBA1B P68363 1/20 0.44
▸ TUBA4A P68366 1/20 0.44
▸ TUBB4B P68371 1/20 0.44
▸ TUBB3 Q13509 1/20 0.44
▸ TUBB2A Q13885 1/20 0.44
▸ TUBB8 Q3ZCM7 1/20 0.44
▸ TUBA3E Q6PEY2 1/20 0.44
▸ TUBA1A Q71U36 1/20 0.44
▸ TUBA1C Q9BQE3 1/20 0.44
▸ TUBB6 Q9BUF5 1/20 0.44
▸ TUBB2B Q9BVA1 1/20 0.44
▸ TUBB1 Q9H4B7 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.39
▸ GAA P10253 1/20 0.39

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
SCHEMBL15066456 0.91 HDAC8 (0.47) HDAC8HDAC11HDAC6TUBB4ATUBB
SCHEMBL16443333 0.89 GRM5 (0.45) HDAC8HDAC11HDAC6TUBB4ATUBB
SCHEMBL16443406 0.86 HDAC6 (0.46) HDAC8HDAC11HDAC6TUBB4ATUBB
SCHEMBL16443577 0.84 HDAC8 (0.45) HDAC8HDAC11HDAC6TUBB4ATUBB
SCHEMBL15066399 0.81 CCNC (0.40) HDAC8HDAC11HDAC6TUBB4ATUBB
SCHEMBL15068419 0.79 SMN1; SMN2 (0.48) HDAC8HDAC11HDAC6ALDH1A1HDAC4
SCHEMBL15068422 0.79 SMN1; SMN2 (0.48) HDAC8HDAC11HDAC6ALDH1A1HDAC4
SCHEMBL15065683 0.78 HDAC4 (0.52) HDAC8HDAC11HDAC6ALDH1A1GAA
SCHEMBL15065907 0.78 HDAC4 (0.52) HDAC8HDAC11HDAC6ALDH1A1GAA
SCHEMBL15065350 0.76 HDAC8 (0.46) HDAC8HDAC11HDAC6ALDH1A1HDAC4

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150045367-A1 CINNAMIC ACID HYDROXYAMIDES AS INHIBITORS OF HISTONE DEACETYLASE 8 PHARMACYCLICS LLC 2015-02-12 — — US claimed
EP-2797875-A1 CINNAMIC ACID HYDROXYAMIDES AS INHIBITORS OF HISTONE DEACETYLASE 8 Pharmacyclics, Inc. (US) 2014-11-05 — — EP claimed
CN-104136410-A CINNAMIC ACID HYDROXYAMIDES AS INHIBITORS OF HISTONE DEACETYLASE 8 PHARMACYCLICS INC 2014-11-05 — — CN claimed
WO-2013101600-A1 CINNAMIC ACID HYDROXYAMIDES AS INHIBITORS OF HISTONE DEACETYLASE 8 PHARMACYCLICS, INC. (US) 2013-07-04 — — WO claimed
US-20150045367-A1 CINNAMIC ACID HYDROXYAMIDES AS INHIBITORS OF HISTONE DEACETYLASE 8 PHARMACYCLICS LLC 2015-02-12 — — US disclosed
CN-104136410-A CINNAMIC ACID HYDROXYAMIDES AS INHIBITORS OF HISTONE DEACETYLASE 8 PHARMACYCLICS INC 2014-11-05 — — CN 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-20150045367-A1 CINNAMIC ACID HYDROXYAMIDES AS INHIBITORS OF HISTONE DEACETYLASE 8 HDAC8, HDAC5, HDAC7 HDAC8 1/4885HDAC11 8/4885HDAC6 11/4885

“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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